Homec4science
Diffusion lammps (master) Browse

lammps/tools/msi2lmp/test/decane-oplsaa.mdf
47d6451d033amaster

Last Change
Raw File

decane-oplsaa.mdf
View Options

!BIOSYM molecular_data 4
!Date: Mon Sep 14 13:11:17 2015 Materials Studio Generated MDF file
#topology
@column 1 element
@column 2 atom_type
@column 3 charge_group
@column 4 isotope
@column 5 formal_charge
@column 6 charge
@column 7 switching_atom
@column 8 oop_flag
@column 9 chirality_flag
@column 10 occupancy
@column 11 xray_temp_factor
@column 12 connections
@molecule decane_box
R1_1:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H1 H3
R1_1:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R1_1:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R1_1:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R1_1:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R1_1:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R1_1:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R1_1:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R1_1:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R1_1:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R1_1:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R1_1:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R1_1:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R1_1:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R1_1:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R1_1:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R1_1:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R1_1:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R1_1:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R1_1:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R1_1:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R1_1:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R1_1:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R1_1:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R1_1:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R1_1:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R1_1:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R1_1:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R1_1:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R1_1:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R1_1:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R1_1:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R2_2:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H3 H2
R2_2:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R2_2:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R2_2:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R2_2:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R2_2:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R2_2:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R2_2:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R2_2:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R2_2:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R2_2:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R2_2:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R2_2:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R2_2:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R2_2:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R2_2:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R2_2:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R2_2:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R2_2:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R2_2:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R2_2:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R2_2:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R2_2:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R2_2:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R2_2:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R2_2:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R2_2:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R2_2:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R2_2:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R2_2:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R2_2:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R2_2:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R3_3:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R3_3:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R3_3:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R3_3:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R3_3:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R3_3:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R3_3:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R3_3:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R3_3:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R3_3:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R3_3:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R3_3:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R3_3:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R3_3:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R3_3:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R3_3:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R3_3:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R3_3:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R3_3:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R3_3:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R3_3:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R3_3:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R3_3:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R3_3:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R3_3:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R3_3:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R3_3:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R3_3:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R3_3:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R3_3:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R3_3:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R3_3:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R4_4:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R4_4:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R4_4:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R4_4:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R4_4:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R4_4:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R4_4:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R4_4:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R4_4:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R4_4:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R4_4:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R4_4:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R4_4:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R4_4:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R4_4:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R4_4:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R4_4:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R4_4:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R4_4:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R4_4:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R4_4:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R4_4:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R4_4:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R4_4:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R4_4:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R4_4:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R4_4:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R4_4:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R4_4:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R4_4:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R4_4:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R4_4:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R5_5:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H1 H2
R5_5:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R5_5:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R5_5:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R5_5:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R5_5:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R5_5:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R5_5:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R5_5:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R5_5:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R5_5:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R5_5:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R5_5:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R5_5:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R5_5:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R5_5:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R5_5:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R5_5:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R5_5:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R5_5:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R5_5:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R5_5:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R5_5:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R5_5:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R5_5:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R5_5:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R5_5:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R5_5:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R5_5:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R5_5:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R5_5:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R5_5:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R6_6:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 C2 H2 H1
R6_6:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R6_6:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R6_6:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R6_6:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R6_6:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R6_6:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R6_6:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R6_6:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R6_6:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R6_6:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R6_6:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R6_6:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R6_6:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R6_6:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R6_6:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R6_6:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R6_6:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R6_6:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R6_6:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R6_6:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R6_6:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R6_6:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R6_6:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R6_6:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R6_6:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R6_6:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R6_6:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R6_6:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R6_6:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R6_6:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R6_6:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R7_7:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 H3 C2
R7_7:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R7_7:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R7_7:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R7_7:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R7_7:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R7_7:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R7_7:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R7_7:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R7_7:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R7_7:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R7_7:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R7_7:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R7_7:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R7_7:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R7_7:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R7_7:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R7_7:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R7_7:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R7_7:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R7_7:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R7_7:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R7_7:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R7_7:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R7_7:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R7_7:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R7_7:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R7_7:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R7_7:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R7_7:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R7_7:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R7_7:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R8_8:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 H2 C2
R8_8:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R8_8:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R8_8:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R8_8:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R8_8:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R8_8:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R8_8:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R8_8:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R8_8:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R8_8:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R8_8:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R8_8:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R8_8:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R8_8:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R8_8:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R8_8:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R8_8:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R8_8:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R8_8:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R8_8:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R8_8:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R8_8:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R8_8:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R8_8:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R8_8:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R8_8:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R8_8:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R8_8:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R8_8:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R8_8:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R8_8:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R9_9:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 C2 H1 H2
R9_9:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R9_9:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R9_9:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R9_9:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R9_9:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R9_9:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R9_9:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R9_9:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R9_9:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R9_9:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R9_9:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R9_9:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R9_9:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R9_9:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R9_9:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R9_9:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R9_9:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R9_9:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R9_9:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R9_9:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R9_9:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R9_9:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R9_9:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R9_9:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R9_9:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R9_9:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R9_9:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R9_9:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R9_9:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R9_9:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R9_9:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R10_10:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R10_10:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R10_10:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R10_10:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R10_10:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R10_10:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R10_10:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R10_10:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R10_10:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R10_10:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R10_10:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R10_10:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R10_10:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R10_10:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R10_10:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R10_10:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R10_10:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R10_10:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R10_10:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R10_10:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R10_10:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R10_10:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R10_10:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R10_10:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R10_10:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R10_10:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R10_10:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R10_10:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R10_10:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R10_10:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R10_10:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R10_10:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R11_11:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R11_11:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R11_11:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R11_11:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R11_11:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R11_11:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R11_11:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R11_11:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R11_11:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R11_11:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R11_11:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R11_11:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R11_11:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R11_11:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R11_11:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R11_11:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R11_11:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R11_11:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R11_11:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R11_11:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R11_11:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R11_11:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R11_11:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R11_11:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R11_11:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R11_11:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R11_11:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R11_11:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R11_11:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R11_11:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R11_11:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R11_11:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R12_12:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R12_12:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R12_12:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R12_12:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R12_12:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R12_12:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R12_12:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R12_12:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R12_12:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R12_12:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R12_12:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R12_12:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R12_12:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R12_12:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R12_12:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R12_12:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R12_12:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R12_12:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R12_12:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R12_12:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R12_12:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R12_12:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R12_12:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R12_12:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R12_12:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R12_12:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R12_12:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R12_12:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R12_12:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R12_12:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R12_12:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R12_12:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R13_13:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H3 H1
R13_13:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R13_13:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R13_13:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R13_13:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R13_13:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R13_13:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R13_13:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R13_13:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R13_13:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R13_13:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R13_13:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R13_13:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R13_13:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R13_13:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R13_13:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R13_13:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R13_13:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R13_13:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R13_13:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R13_13:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R13_13:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R13_13:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R13_13:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R13_13:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R13_13:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R13_13:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R13_13:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R13_13:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R13_13:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R13_13:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R13_13:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R14_14:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R14_14:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R14_14:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R14_14:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R14_14:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R14_14:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R14_14:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R14_14:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R14_14:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R14_14:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R14_14:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R14_14:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R14_14:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R14_14:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R14_14:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R14_14:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R14_14:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R14_14:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R14_14:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R14_14:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R14_14:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R14_14:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R14_14:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R14_14:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R14_14:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R14_14:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R14_14:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R14_14:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R14_14:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R14_14:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R14_14:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R14_14:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R15_15:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 H1 C2
R15_15:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R15_15:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R15_15:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R15_15:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R15_15:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R15_15:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R15_15:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R15_15:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R15_15:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R15_15:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R15_15:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R15_15:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R15_15:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R15_15:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R15_15:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R15_15:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R15_15:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R15_15:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R15_15:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R15_15:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R15_15:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R15_15:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R15_15:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R15_15:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R15_15:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R15_15:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R15_15:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R15_15:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R15_15:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R15_15:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R15_15:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R16_16:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 C2 H2
R16_16:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R16_16:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R16_16:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R16_16:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R16_16:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R16_16:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R16_16:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R16_16:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R16_16:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R16_16:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R16_16:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R16_16:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R16_16:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R16_16:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R16_16:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R16_16:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R16_16:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R16_16:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R16_16:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R16_16:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R16_16:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R16_16:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R16_16:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R16_16:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R16_16:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R16_16:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R16_16:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R16_16:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R16_16:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R16_16:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R16_16:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R17_17:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R17_17:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R17_17:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R17_17:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R17_17:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R17_17:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R17_17:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R17_17:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R17_17:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R17_17:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R17_17:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R17_17:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R17_17:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R17_17:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R17_17:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R17_17:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R17_17:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R17_17:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R17_17:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R17_17:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R17_17:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R17_17:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R17_17:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R17_17:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R17_17:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R17_17:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R17_17:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R17_17:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R17_17:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R17_17:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R17_17:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R17_17:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R18_18:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R18_18:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R18_18:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R18_18:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R18_18:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R18_18:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R18_18:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R18_18:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R18_18:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R18_18:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R18_18:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R18_18:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R18_18:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R18_18:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R18_18:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R18_18:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R18_18:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R18_18:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R18_18:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R18_18:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R18_18:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R18_18:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R18_18:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R18_18:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R18_18:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R18_18:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R18_18:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R18_18:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R18_18:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R18_18:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R18_18:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R18_18:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R19_19:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R19_19:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R19_19:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R19_19:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R19_19:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R19_19:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R19_19:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R19_19:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R19_19:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R19_19:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R19_19:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R19_19:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R19_19:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R19_19:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R19_19:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R19_19:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R19_19:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R19_19:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R19_19:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R19_19:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R19_19:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R19_19:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R19_19:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R19_19:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R19_19:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R19_19:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R19_19:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R19_19:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R19_19:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R19_19:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R19_19:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R19_19:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R20_20:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R20_20:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R20_20:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R20_20:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R20_20:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R20_20:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R20_20:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R20_20:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R20_20:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R20_20:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R20_20:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R20_20:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R20_20:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R20_20:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R20_20:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R20_20:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R20_20:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R20_20:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R20_20:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R20_20:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R20_20:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R20_20:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R20_20:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R20_20:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R20_20:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R20_20:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R20_20:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R20_20:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R20_20:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R20_20:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R20_20:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R20_20:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R21_21:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R21_21:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R21_21:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R21_21:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R21_21:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R21_21:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R21_21:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R21_21:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R21_21:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R21_21:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R21_21:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R21_21:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R21_21:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R21_21:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R21_21:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R21_21:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R21_21:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R21_21:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R21_21:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R21_21:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R21_21:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R21_21:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R21_21:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R21_21:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R21_21:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R21_21:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R21_21:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R21_21:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R21_21:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R21_21:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R21_21:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R21_21:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R22_22:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H1 C2 H3
R22_22:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R22_22:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R22_22:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R22_22:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R22_22:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R22_22:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R22_22:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R22_22:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R22_22:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R22_22:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R22_22:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R22_22:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R22_22:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R22_22:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R22_22:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R22_22:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R22_22:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R22_22:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R22_22:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R22_22:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R22_22:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R22_22:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R22_22:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R22_22:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R22_22:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R22_22:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R22_22:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R22_22:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R22_22:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R22_22:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R22_22:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R23_23:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H1 H2
R23_23:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R23_23:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R23_23:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R23_23:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R23_23:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R23_23:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R23_23:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R23_23:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R23_23:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R23_23:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R23_23:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R23_23:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R23_23:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R23_23:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R23_23:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R23_23:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R23_23:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R23_23:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R23_23:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R23_23:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R23_23:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R23_23:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R23_23:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R23_23:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R23_23:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R23_23:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R23_23:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R23_23:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R23_23:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R23_23:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R23_23:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R24_24:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R24_24:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R24_24:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R24_24:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R24_24:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R24_24:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R24_24:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R24_24:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R24_24:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R24_24:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R24_24:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R24_24:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R24_24:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R24_24:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R24_24:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R24_24:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R24_24:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R24_24:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R24_24:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R24_24:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R24_24:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R24_24:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R24_24:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R24_24:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R24_24:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R24_24:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R24_24:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R24_24:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R24_24:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R24_24:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R24_24:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R24_24:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R25_25:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R25_25:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R25_25:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R25_25:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R25_25:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R25_25:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R25_25:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R25_25:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R25_25:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R25_25:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R25_25:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R25_25:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R25_25:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R25_25:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R25_25:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R25_25:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R25_25:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R25_25:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R25_25:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R25_25:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R25_25:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R25_25:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R25_25:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R25_25:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R25_25:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R25_25:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R25_25:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R25_25:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R25_25:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R25_25:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R25_25:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R25_25:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R26_26:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H1 C2 H3
R26_26:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R26_26:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R26_26:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R26_26:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R26_26:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R26_26:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R26_26:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R26_26:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R26_26:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R26_26:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R26_26:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R26_26:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R26_26:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R26_26:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R26_26:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R26_26:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R26_26:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R26_26:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R26_26:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R26_26:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R26_26:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R26_26:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R26_26:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R26_26:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R26_26:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R26_26:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R26_26:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R26_26:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R26_26:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R26_26:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R26_26:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R27_27:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R27_27:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R27_27:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R27_27:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R27_27:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R27_27:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R27_27:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R27_27:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H7 H6
R27_27:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R27_27:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R27_27:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R27_27:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R27_27:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R27_27:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R27_27:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R27_27:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R27_27:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R27_27:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R27_27:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R27_27:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R27_27:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R27_27:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R27_27:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R27_27:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R27_27:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R27_27:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R27_27:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R27_27:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R27_27:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R27_27:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R27_27:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R27_27:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R28_28:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R28_28:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R28_28:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R28_28:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R28_28:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R28_28:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R28_28:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R28_28:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R28_28:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R28_28:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R28_28:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R28_28:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R28_28:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R28_28:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R28_28:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R28_28:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R28_28:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R28_28:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R28_28:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R28_28:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R28_28:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R28_28:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R28_28:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R28_28:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R28_28:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R28_28:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R28_28:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R28_28:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R28_28:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R28_28:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R28_28:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R28_28:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R29_29:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H1 H3 C2
R29_29:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R29_29:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R29_29:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R29_29:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R29_29:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R29_29:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R29_29:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R29_29:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R29_29:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R29_29:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R29_29:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R29_29:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R29_29:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R29_29:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R29_29:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R29_29:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R29_29:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R29_29:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R29_29:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R29_29:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R29_29:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R29_29:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R29_29:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R29_29:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R29_29:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R29_29:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R29_29:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R29_29:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R29_29:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R29_29:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R29_29:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R30_30:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H3 H2
R30_30:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R30_30:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R30_30:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R30_30:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R30_30:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R30_30:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R30_30:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R30_30:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R30_30:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R30_30:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R30_30:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R30_30:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R30_30:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R30_30:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R30_30:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R30_30:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R30_30:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R30_30:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R30_30:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R30_30:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R30_30:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R30_30:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R30_30:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R30_30:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R30_30:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R30_30:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R30_30:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R30_30:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R30_30:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R30_30:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R30_30:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R31_31:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 C2 H2
R31_31:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R31_31:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R31_31:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R31_31:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R31_31:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R31_31:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R31_31:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R31_31:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R31_31:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R31_31:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R31_31:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R31_31:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R31_31:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R31_31:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R31_31:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R31_31:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R31_31:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R31_31:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R31_31:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R31_31:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R31_31:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R31_31:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R31_31:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R31_31:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R31_31:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H19 H18
R31_31:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R31_31:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R31_31:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R31_31:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R31_31:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R31_31:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R32_32:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H2 H3
R32_32:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R32_32:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R32_32:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R32_32:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R32_32:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R32_32:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R32_32:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R32_32:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R32_32:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R32_32:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R32_32:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R32_32:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R32_32:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R32_32:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R32_32:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R32_32:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R32_32:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R32_32:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R32_32:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R32_32:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R32_32:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R32_32:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R32_32:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R32_32:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R32_32:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R32_32:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R32_32:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R32_32:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R32_32:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R32_32:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R32_32:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R33_33:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 H2 C2
R33_33:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R33_33:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R33_33:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R33_33:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R33_33:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R33_33:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R33_33:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R33_33:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R33_33:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R33_33:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R33_33:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R33_33:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R33_33:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R33_33:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R33_33:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R33_33:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R33_33:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R33_33:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R33_33:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R33_33:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R33_33:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R33_33:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R33_33:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R33_33:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R33_33:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R33_33:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R33_33:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R33_33:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R33_33:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R33_33:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R33_33:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R34_34:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H3 H1
R34_34:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R34_34:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R34_34:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R34_34:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R34_34:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R34_34:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R34_34:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R34_34:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R34_34:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R34_34:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R34_34:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R34_34:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R34_34:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R34_34:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R34_34:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R34_34:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R34_34:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R34_34:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R34_34:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R34_34:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R34_34:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R34_34:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R34_34:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R34_34:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R34_34:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R34_34:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R34_34:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R34_34:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R34_34:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R34_34:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R34_34:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R35_35:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R35_35:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R35_35:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R35_35:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R35_35:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R35_35:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R35_35:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R35_35:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R35_35:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R35_35:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R35_35:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R35_35:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R35_35:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R35_35:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R35_35:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R35_35:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R35_35:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R35_35:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R35_35:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R35_35:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R35_35:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R35_35:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R35_35:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R35_35:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R35_35:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R35_35:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R35_35:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R35_35:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R35_35:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R35_35:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R35_35:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R35_35:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R36_36:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 H3 C2
R36_36:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R36_36:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R36_36:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R36_36:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R36_36:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R36_36:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R36_36:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R36_36:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R36_36:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R36_36:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R36_36:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R36_36:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R36_36:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R36_36:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R36_36:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R36_36:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R36_36:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R36_36:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R36_36:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R36_36:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R36_36:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R36_36:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R36_36:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R36_36:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R36_36:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R36_36:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R36_36:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R36_36:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R36_36:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R36_36:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R36_36:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R37_37:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R37_37:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R37_37:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R37_37:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R37_37:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R37_37:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R37_37:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R37_37:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R37_37:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R37_37:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R37_37:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R37_37:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R37_37:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R37_37:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R37_37:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R37_37:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R37_37:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R37_37:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R37_37:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R37_37:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R37_37:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R37_37:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R37_37:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R37_37:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R37_37:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R37_37:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R37_37:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R37_37:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R37_37:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R37_37:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R37_37:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R37_37:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R38_38:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 C2 H2
R38_38:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R38_38:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R38_38:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R38_38:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R38_38:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R38_38:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R38_38:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R38_38:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R38_38:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R38_38:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R38_38:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R38_38:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R38_38:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R38_38:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R38_38:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R38_38:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R38_38:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R38_38:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R38_38:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R38_38:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R38_38:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R38_38:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R38_38:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R38_38:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R38_38:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R38_38:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R38_38:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R38_38:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R38_38:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R38_38:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R38_38:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R39_39:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H3 H1
R39_39:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R39_39:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R39_39:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R39_39:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R39_39:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R39_39:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R39_39:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R39_39:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R39_39:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R39_39:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R39_39:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R39_39:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R39_39:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R39_39:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R39_39:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R39_39:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R39_39:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R39_39:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R39_39:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R39_39:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R39_39:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R39_39:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R39_39:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R39_39:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R39_39:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R39_39:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R39_39:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R39_39:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R39_39:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R39_39:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R39_39:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R40_40:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 H2 C2
R40_40:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R40_40:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R40_40:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R40_40:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R40_40:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R40_40:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R40_40:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R40_40:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R40_40:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R40_40:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R40_40:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R40_40:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R40_40:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R40_40:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R40_40:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R40_40:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R40_40:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R40_40:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R40_40:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R40_40:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R40_40:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R40_40:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R40_40:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R40_40:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R40_40:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R40_40:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R40_40:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R40_40:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R40_40:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R40_40:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R40_40:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R41_41:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H1 H2
R41_41:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R41_41:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R41_41:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R41_41:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R41_41:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R41_41:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R41_41:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R41_41:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R41_41:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R41_41:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R41_41:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R41_41:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R41_41:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R41_41:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R41_41:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R41_41:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R41_41:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R41_41:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R41_41:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R41_41:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R41_41:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R41_41:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R41_41:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R41_41:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R41_41:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R41_41:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R41_41:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R41_41:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R41_41:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R41_41:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R41_41:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R42_42:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 H2 C2
R42_42:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R42_42:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R42_42:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R42_42:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R42_42:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R42_42:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R42_42:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R42_42:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R42_42:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R42_42:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R42_42:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R42_42:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R42_42:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R42_42:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R42_42:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R42_42:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R42_42:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R42_42:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R42_42:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R42_42:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R42_42:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R42_42:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R42_42:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R42_42:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R42_42:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R42_42:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R42_42:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R42_42:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R42_42:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R42_42:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R42_42:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R43_43:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R43_43:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R43_43:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R43_43:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R43_43:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R43_43:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R43_43:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R43_43:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R43_43:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R43_43:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R43_43:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R43_43:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R43_43:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R43_43:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R43_43:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R43_43:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R43_43:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R43_43:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R43_43:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R43_43:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R43_43:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R43_43:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R43_43:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R43_43:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R43_43:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R43_43:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R43_43:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R43_43:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R43_43:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R43_43:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R43_43:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R43_43:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R44_44:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R44_44:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R44_44:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R44_44:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R44_44:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R44_44:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R44_44:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R44_44:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R44_44:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R44_44:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R44_44:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R44_44:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R44_44:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R44_44:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R44_44:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R44_44:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R44_44:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R44_44:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R44_44:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R44_44:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R44_44:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R44_44:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R44_44:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R44_44:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R44_44:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R44_44:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R44_44:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R44_44:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R44_44:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H20 H22
R44_44:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R44_44:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R44_44:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R45_45:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H1 H3
R45_45:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R45_45:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R45_45:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R45_45:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R45_45:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R45_45:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R45_45:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R45_45:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R45_45:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R45_45:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R45_45:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R45_45:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R45_45:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R45_45:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R45_45:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R45_45:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R45_45:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R45_45:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R45_45:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R45_45:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R45_45:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R45_45:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R45_45:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R45_45:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R45_45:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R45_45:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R45_45:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R45_45:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R45_45:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R45_45:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R45_45:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R46_46:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 H3 C2
R46_46:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R46_46:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R46_46:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R46_46:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R46_46:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R46_46:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R46_46:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R46_46:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R46_46:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R46_46:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R46_46:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R46_46:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R46_46:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R46_46:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R46_46:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R46_46:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R46_46:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R46_46:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R46_46:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R46_46:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R46_46:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R46_46:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R46_46:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R46_46:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R46_46:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R46_46:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R46_46:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R46_46:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R46_46:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R46_46:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R46_46:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R47_47:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R47_47:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R47_47:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R47_47:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R47_47:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R47_47:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R47_47:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R47_47:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R47_47:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R47_47:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R47_47:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R47_47:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R47_47:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R47_47:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R47_47:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R47_47:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R47_47:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R47_47:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R47_47:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R47_47:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R47_47:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R47_47:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R47_47:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R47_47:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R47_47:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R47_47:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R47_47:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R47_47:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R47_47:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R47_47:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R47_47:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R47_47:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R48_48:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 H3 C2
R48_48:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R48_48:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R48_48:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R48_48:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R48_48:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R48_48:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R48_48:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H7 H6
R48_48:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R48_48:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R48_48:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R48_48:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R48_48:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R48_48:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R48_48:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R48_48:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R48_48:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R48_48:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R48_48:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R48_48:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R48_48:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R48_48:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R48_48:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R48_48:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R48_48:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R48_48:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H19 H18
R48_48:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R48_48:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R48_48:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R48_48:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R48_48:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R48_48:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R49_49:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H1 H3 H2
R49_49:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R49_49:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R49_49:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R49_49:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R49_49:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R49_49:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R49_49:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R49_49:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R49_49:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R49_49:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R49_49:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R49_49:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R49_49:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R49_49:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R49_49:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R49_49:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R49_49:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R49_49:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R49_49:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R49_49:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R49_49:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R49_49:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R49_49:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R49_49:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R49_49:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R49_49:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R49_49:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R49_49:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R49_49:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R49_49:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R49_49:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R50_50:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H2 H1
R50_50:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R50_50:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R50_50:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R50_50:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R50_50:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R50_50:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R50_50:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R50_50:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R50_50:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R50_50:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R50_50:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R50_50:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R50_50:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R50_50:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R50_50:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R50_50:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R50_50:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R50_50:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R50_50:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R50_50:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R50_50:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R50_50:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R50_50:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R50_50:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R50_50:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H19 H18
R50_50:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R50_50:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R50_50:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R50_50:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R50_50:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R50_50:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R51_51:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H3 H1
R51_51:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R51_51:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R51_51:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R51_51:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R51_51:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R51_51:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R51_51:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R51_51:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R51_51:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R51_51:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R51_51:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R51_51:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R51_51:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R51_51:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R51_51:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R51_51:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R51_51:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R51_51:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R51_51:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R51_51:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R51_51:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R51_51:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R51_51:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R51_51:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R51_51:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R51_51:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R51_51:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R51_51:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R51_51:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R51_51:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R51_51:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R52_52:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 C2 H2 H1
R52_52:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R52_52:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R52_52:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R52_52:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R52_52:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R52_52:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R52_52:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R52_52:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R52_52:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R52_52:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R52_52:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R52_52:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R52_52:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R52_52:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R52_52:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R52_52:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R52_52:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R52_52:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R52_52:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R52_52:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R52_52:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R52_52:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R52_52:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R52_52:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R52_52:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R52_52:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R52_52:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R52_52:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R52_52:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R52_52:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R52_52:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R53_53:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R53_53:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R53_53:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R53_53:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R53_53:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R53_53:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R53_53:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R53_53:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R53_53:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R53_53:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R53_53:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R53_53:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R53_53:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R53_53:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R53_53:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R53_53:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R53_53:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R53_53:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R53_53:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R53_53:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R53_53:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R53_53:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R53_53:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R53_53:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R53_53:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R53_53:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R53_53:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R53_53:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R53_53:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R53_53:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R53_53:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R53_53:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R54_54:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R54_54:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R54_54:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R54_54:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R54_54:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R54_54:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R54_54:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R54_54:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R54_54:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R54_54:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R54_54:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R54_54:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R54_54:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R54_54:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R54_54:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R54_54:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R54_54:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R54_54:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R54_54:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R54_54:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R54_54:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R54_54:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R54_54:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R54_54:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R54_54:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R54_54:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R54_54:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R54_54:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R54_54:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R54_54:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R54_54:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R54_54:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R55_55:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 H1 C2
R55_55:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R55_55:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R55_55:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R55_55:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R55_55:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R55_55:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R55_55:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R55_55:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R55_55:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R55_55:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R55_55:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R55_55:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R55_55:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R55_55:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R55_55:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R55_55:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R55_55:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R55_55:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R55_55:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R55_55:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R55_55:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R55_55:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R55_55:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R55_55:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R55_55:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R55_55:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R55_55:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R55_55:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R55_55:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R55_55:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R55_55:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R56_56:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R56_56:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R56_56:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R56_56:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R56_56:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R56_56:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R56_56:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R56_56:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R56_56:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R56_56:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R56_56:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R56_56:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R56_56:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R56_56:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R56_56:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R56_56:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R56_56:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R56_56:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R56_56:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R56_56:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R56_56:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R56_56:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R56_56:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R56_56:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R56_56:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R56_56:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R56_56:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R56_56:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R56_56:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R56_56:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R56_56:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R56_56:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R57_57:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H1 H3 H2
R57_57:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R57_57:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R57_57:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R57_57:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R57_57:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R57_57:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R57_57:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R57_57:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R57_57:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R57_57:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R57_57:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R57_57:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R57_57:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R57_57:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R57_57:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R57_57:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R57_57:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R57_57:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R57_57:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R57_57:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R57_57:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R57_57:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R57_57:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R57_57:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R57_57:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R57_57:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R57_57:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R57_57:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R57_57:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R57_57:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R57_57:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R58_58:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 H2 C2
R58_58:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R58_58:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R58_58:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R58_58:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R58_58:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R58_58:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R58_58:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R58_58:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R58_58:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R58_58:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R58_58:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R58_58:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R58_58:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R58_58:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R58_58:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R58_58:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R58_58:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R58_58:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R58_58:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R58_58:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R58_58:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R58_58:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R58_58:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R58_58:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R58_58:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H19 H18
R58_58:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R58_58:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R58_58:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R58_58:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R58_58:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R58_58:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R59_59:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 H3 C2
R59_59:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R59_59:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R59_59:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R59_59:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R59_59:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R59_59:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R59_59:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R59_59:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R59_59:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R59_59:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R59_59:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R59_59:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R59_59:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R59_59:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R59_59:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R59_59:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R59_59:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R59_59:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R59_59:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R59_59:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R59_59:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R59_59:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R59_59:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R59_59:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R59_59:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R59_59:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R59_59:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R59_59:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H20 H22
R59_59:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R59_59:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R59_59:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R60_60:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 C2 H3
R60_60:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R60_60:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R60_60:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R60_60:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R60_60:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R60_60:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R60_60:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R60_60:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R60_60:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R60_60:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R60_60:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R60_60:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R60_60:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R60_60:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R60_60:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R60_60:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R60_60:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R60_60:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R60_60:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R60_60:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R60_60:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R60_60:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R60_60:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R60_60:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R60_60:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R60_60:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R60_60:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R60_60:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R60_60:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R60_60:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R60_60:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R61_61:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R61_61:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R61_61:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R61_61:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R61_61:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R61_61:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R61_61:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R61_61:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R61_61:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R61_61:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R61_61:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H8 H9
R61_61:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R61_61:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R61_61:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R61_61:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R61_61:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R61_61:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R61_61:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R61_61:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R61_61:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R61_61:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R61_61:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R61_61:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R61_61:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R61_61:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R61_61:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R61_61:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R61_61:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R61_61:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R61_61:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R61_61:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R61_61:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R62_62:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H3 H1
R62_62:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R62_62:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R62_62:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R62_62:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R62_62:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R62_62:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R62_62:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R62_62:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R62_62:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R62_62:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R62_62:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R62_62:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R62_62:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R62_62:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R62_62:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R62_62:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R62_62:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R62_62:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R62_62:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R62_62:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R62_62:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R62_62:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R62_62:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R62_62:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R62_62:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R62_62:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R62_62:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R62_62:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R62_62:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R62_62:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R62_62:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R63_63:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R63_63:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R63_63:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R63_63:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R63_63:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R63_63:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R63_63:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R63_63:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R63_63:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R63_63:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R63_63:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R63_63:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R63_63:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R63_63:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R63_63:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R63_63:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R63_63:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R63_63:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R63_63:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R63_63:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R63_63:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R63_63:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R63_63:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R63_63:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R63_63:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R63_63:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R63_63:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R63_63:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R63_63:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R63_63:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R63_63:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R63_63:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R64_64:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H2 H1
R64_64:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R64_64:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R64_64:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R64_64:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R64_64:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R64_64:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R64_64:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H7 H6
R64_64:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R64_64:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R64_64:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R64_64:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R64_64:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R64_64:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R64_64:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R64_64:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R64_64:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R64_64:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R64_64:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R64_64:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R64_64:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R64_64:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R64_64:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R64_64:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R64_64:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R64_64:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R64_64:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R64_64:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R64_64:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R64_64:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R64_64:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R64_64:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R65_65:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H1 C2 H2
R65_65:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R65_65:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R65_65:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R65_65:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R65_65:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R65_65:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R65_65:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R65_65:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R65_65:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R65_65:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R65_65:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R65_65:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R65_65:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R65_65:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R65_65:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R65_65:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R65_65:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R65_65:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R65_65:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R65_65:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R65_65:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R65_65:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R65_65:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R65_65:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R65_65:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R65_65:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R65_65:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R65_65:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H20 H22
R65_65:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R65_65:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R65_65:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R66_66:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H3 H2
R66_66:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R66_66:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R66_66:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R66_66:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R66_66:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R66_66:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R66_66:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R66_66:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R66_66:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R66_66:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R66_66:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R66_66:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R66_66:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R66_66:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R66_66:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R66_66:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R66_66:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R66_66:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R66_66:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R66_66:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R66_66:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R66_66:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R66_66:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R66_66:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R66_66:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R66_66:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R66_66:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R66_66:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R66_66:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R66_66:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R66_66:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R67_67:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 C2 H1 H2
R67_67:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R67_67:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R67_67:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R67_67:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R67_67:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R67_67:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R67_67:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R67_67:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R67_67:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R67_67:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R67_67:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R67_67:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R67_67:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R67_67:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R67_67:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R67_67:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R67_67:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R67_67:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R67_67:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R67_67:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R67_67:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R67_67:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R67_67:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R67_67:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R67_67:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R67_67:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R67_67:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R67_67:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R67_67:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R67_67:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R67_67:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R68_68:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H3 H2
R68_68:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R68_68:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R68_68:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R68_68:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R68_68:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R68_68:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R68_68:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R68_68:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R68_68:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R68_68:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R68_68:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R68_68:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R68_68:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R68_68:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R68_68:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R68_68:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R68_68:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R68_68:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R68_68:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R68_68:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R68_68:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R68_68:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R68_68:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R68_68:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R68_68:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R68_68:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R68_68:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R68_68:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R68_68:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R68_68:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R68_68:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R69_69:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H1 H2
R69_69:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R69_69:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R69_69:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R69_69:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R69_69:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R69_69:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R69_69:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R69_69:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R69_69:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R69_69:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R69_69:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R69_69:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R69_69:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R69_69:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R69_69:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R69_69:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R69_69:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R69_69:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R69_69:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R69_69:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R69_69:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R69_69:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R69_69:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R69_69:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R69_69:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H19 H18
R69_69:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R69_69:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R69_69:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R69_69:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R69_69:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R69_69:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R70_70:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R70_70:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R70_70:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R70_70:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R70_70:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R70_70:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R70_70:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R70_70:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R70_70:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R70_70:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R70_70:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R70_70:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R70_70:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R70_70:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R70_70:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R70_70:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R70_70:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R70_70:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R70_70:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R70_70:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R70_70:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R70_70:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R70_70:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R70_70:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R70_70:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R70_70:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R70_70:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R70_70:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R70_70:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R70_70:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R70_70:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R70_70:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R71_71:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 H1 C2
R71_71:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R71_71:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R71_71:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R71_71:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 H4 C3
R71_71:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R71_71:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R71_71:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R71_71:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R71_71:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R71_71:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R71_71:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R71_71:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R71_71:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R71_71:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R71_71:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R71_71:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R71_71:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R71_71:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R71_71:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R71_71:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R71_71:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R71_71:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R71_71:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R71_71:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R71_71:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R71_71:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R71_71:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R71_71:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R71_71:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R71_71:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R71_71:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R72_72:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H3 H2
R72_72:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R72_72:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R72_72:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R72_72:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R72_72:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R72_72:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R72_72:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R72_72:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R72_72:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R72_72:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R72_72:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R72_72:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R72_72:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R72_72:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R72_72:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R72_72:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R72_72:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R72_72:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R72_72:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R72_72:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R72_72:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R72_72:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R72_72:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R72_72:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R72_72:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R72_72:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R72_72:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R72_72:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R72_72:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R72_72:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R72_72:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R73_73:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R73_73:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R73_73:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R73_73:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R73_73:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R73_73:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R73_73:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R73_73:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R73_73:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R73_73:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R73_73:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R73_73:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R73_73:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R73_73:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R73_73:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R73_73:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R73_73:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R73_73:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R73_73:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R73_73:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R73_73:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R73_73:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R73_73:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R73_73:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R73_73:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R73_73:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R73_73:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R73_73:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R73_73:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R73_73:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R73_73:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R73_73:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R74_74:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R74_74:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R74_74:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R74_74:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R74_74:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R74_74:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R74_74:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R74_74:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R74_74:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R74_74:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R74_74:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R74_74:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R74_74:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R74_74:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R74_74:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R74_74:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R74_74:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R74_74:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R74_74:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R74_74:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R74_74:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R74_74:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R74_74:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R74_74:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R74_74:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R74_74:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R74_74:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R74_74:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R74_74:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R74_74:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R74_74:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R74_74:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R75_75:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H2 H3
R75_75:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R75_75:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R75_75:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R75_75:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R75_75:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R75_75:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R75_75:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R75_75:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R75_75:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R75_75:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R75_75:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R75_75:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R75_75:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R75_75:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R75_75:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R75_75:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R75_75:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R75_75:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R75_75:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R75_75:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R75_75:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R75_75:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R75_75:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R75_75:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R75_75:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R75_75:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R75_75:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R75_75:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R75_75:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R75_75:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R75_75:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R76_76:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R76_76:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R76_76:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R76_76:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R76_76:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R76_76:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R76_76:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R76_76:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R76_76:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R76_76:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R76_76:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R76_76:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R76_76:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R76_76:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R76_76:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R76_76:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R76_76:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H13 H12
R76_76:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R76_76:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R76_76:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R76_76:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R76_76:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R76_76:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R76_76:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R76_76:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R76_76:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R76_76:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R76_76:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R76_76:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R76_76:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R76_76:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R76_76:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R77_77:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H1 H3 H2
R77_77:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R77_77:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R77_77:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R77_77:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R77_77:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R77_77:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R77_77:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R77_77:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R77_77:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R77_77:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R77_77:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R77_77:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R77_77:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R77_77:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R77_77:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R77_77:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R77_77:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R77_77:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R77_77:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R77_77:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R77_77:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R77_77:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R77_77:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R77_77:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R77_77:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R77_77:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R77_77:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R77_77:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R77_77:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R77_77:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R77_77:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R78_78:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H2 H3 H1
R78_78:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R78_78:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R78_78:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R78_78:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R78_78:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R78_78:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R78_78:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R78_78:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R78_78:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R78_78:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R78_78:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R78_78:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R78_78:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R78_78:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R78_78:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R78_78:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R78_78:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R78_78:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R78_78:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R78_78:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R78_78:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R78_78:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R78_78:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R78_78:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R78_78:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R78_78:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R78_78:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R78_78:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R78_78:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R78_78:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R78_78:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R79_79:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 H2 C2
R79_79:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R79_79:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R79_79:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R79_79:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R79_79:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R79_79:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R79_79:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R79_79:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R79_79:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R79_79:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R79_79:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R79_79:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R79_79:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R79_79:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R79_79:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R79_79:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R79_79:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R79_79:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R79_79:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R79_79:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R79_79:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R79_79:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R79_79:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R79_79:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R79_79:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R79_79:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R79_79:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R79_79:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R79_79:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R79_79:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R79_79:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R80_80:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R80_80:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R80_80:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R80_80:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R80_80:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R80_80:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R80_80:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R80_80:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R80_80:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R80_80:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R80_80:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R80_80:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R80_80:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R80_80:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R80_80:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R80_80:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R80_80:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R80_80:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R80_80:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R80_80:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R80_80:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R80_80:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R80_80:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R80_80:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R80_80:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R80_80:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R80_80:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R80_80:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R80_80:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R80_80:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R80_80:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R80_80:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R81_81:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R81_81:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R81_81:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R81_81:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R81_81:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R81_81:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R81_81:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R81_81:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H7 H6
R81_81:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R81_81:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R81_81:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R81_81:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R81_81:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R81_81:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R81_81:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R81_81:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R81_81:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R81_81:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R81_81:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R81_81:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R81_81:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R81_81:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R81_81:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R81_81:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R81_81:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R81_81:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R81_81:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R81_81:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R81_81:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R81_81:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R81_81:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R81_81:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R82_82:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H2 H1
R82_82:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R82_82:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R82_82:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R82_82:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R82_82:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R82_82:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R82_82:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R82_82:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R82_82:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R82_82:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 C5 H9
R82_82:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R82_82:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R82_82:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R82_82:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R82_82:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R82_82:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R82_82:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R82_82:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R82_82:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R82_82:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R82_82:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R82_82:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R82_82:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R82_82:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R82_82:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R82_82:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R82_82:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R82_82:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R82_82:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R82_82:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R82_82:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R83_83:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H1 H3 C2
R83_83:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R83_83:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R83_83:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R83_83:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R83_83:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R83_83:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R83_83:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R83_83:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R83_83:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R83_83:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R83_83:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R83_83:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R83_83:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R83_83:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R83_83:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R83_83:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R83_83:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R83_83:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R83_83:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R83_83:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R83_83:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R83_83:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R83_83:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R83_83:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R83_83:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R83_83:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R83_83:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R83_83:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R83_83:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R83_83:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R83_83:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R84_84:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 C2 H3 H1
R84_84:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R84_84:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R84_84:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R84_84:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R84_84:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R84_84:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R84_84:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R84_84:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R84_84:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R84_84:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R84_84:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R84_84:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R84_84:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R84_84:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R84_84:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R84_84:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R84_84:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R84_84:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R84_84:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R84_84:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R84_84:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R84_84:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R84_84:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R84_84:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R84_84:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R84_84:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R84_84:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R84_84:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R84_84:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R84_84:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R84_84:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R85_85:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 C2 H1 H2
R85_85:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R85_85:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R85_85:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R85_85:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R85_85:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R85_85:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R85_85:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R85_85:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R85_85:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R85_85:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R85_85:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R85_85:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R85_85:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R85_85:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R85_85:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R85_85:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R85_85:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R85_85:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R85_85:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R85_85:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R85_85:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R85_85:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R85_85:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R85_85:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R85_85:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R85_85:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R85_85:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R85_85:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R85_85:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R85_85:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R85_85:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R86_86:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H1 H3 C2
R86_86:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R86_86:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R86_86:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R86_86:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R86_86:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R86_86:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R86_86:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R86_86:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R86_86:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R86_86:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R86_86:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R86_86:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R86_86:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R86_86:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R86_86:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R86_86:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R86_86:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R86_86:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R86_86:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R86_86:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R86_86:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R86_86:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R86_86:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R86_86:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R86_86:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R86_86:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R86_86:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R86_86:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R86_86:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R86_86:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R86_86:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R87_87:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R87_87:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R87_87:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R87_87:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R87_87:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R87_87:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R87_87:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R87_87:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R87_87:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R87_87:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R87_87:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R87_87:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R87_87:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R87_87:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R87_87:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R87_87:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R87_87:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R87_87:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R87_87:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R87_87:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R87_87:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R87_87:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R87_87:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R87_87:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R87_87:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R87_87:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R87_87:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R87_87:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R87_87:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R87_87:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R87_87:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R87_87:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R88_88:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 H2 C2
R88_88:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R88_88:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R88_88:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R88_88:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R88_88:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R88_88:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R88_88:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R88_88:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R88_88:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R88_88:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R88_88:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R88_88:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R88_88:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R88_88:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R88_88:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R88_88:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R88_88:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R88_88:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R88_88:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R88_88:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R88_88:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R88_88:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R88_88:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R88_88:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R88_88:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R88_88:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R88_88:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R88_88:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R88_88:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R88_88:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R88_88:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R89_89:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 C2 H2 H1
R89_89:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R89_89:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R89_89:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R89_89:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R89_89:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R89_89:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R89_89:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 H7 C4
R89_89:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R89_89:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R89_89:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R89_89:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R89_89:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R89_89:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R89_89:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R89_89:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R89_89:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R89_89:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R89_89:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R89_89:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R89_89:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R89_89:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R89_89:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R89_89:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R89_89:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R89_89:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R89_89:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R89_89:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R89_89:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R89_89:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R89_89:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R89_89:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R90_90:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 C2 H1
R90_90:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R90_90:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R90_90:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R90_90:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R90_90:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R90_90:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R90_90:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H7 H6
R90_90:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R90_90:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R90_90:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R90_90:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R90_90:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R90_90:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R90_90:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R90_90:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R90_90:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R90_90:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R90_90:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R90_90:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R90_90:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R90_90:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R90_90:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 H16 C9
R90_90:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R90_90:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R90_90:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R90_90:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R90_90:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R90_90:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H20 H22
R90_90:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R90_90:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R90_90:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R91_91:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H3 H1 C2
R91_91:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R91_91:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R91_91:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R91_91:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 C3 H5
R91_91:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R91_91:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R91_91:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R91_91:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R91_91:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R91_91:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R91_91:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R91_91:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R91_91:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R91_91:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R91_91:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R91_91:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R91_91:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R91_91:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R91_91:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R91_91:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R91_91:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R91_91:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R91_91:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R91_91:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R91_91:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R91_91:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R91_91:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R91_91:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R91_91:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R91_91:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R91_91:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R92_92:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 C2 H2 H3
R92_92:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R92_92:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R92_92:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R92_92:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R92_92:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R92_92:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R92_92:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R92_92:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R92_92:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R92_92:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 H8 C5
R92_92:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R92_92:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R92_92:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R92_92:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R92_92:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R92_92:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 H13 C7
R92_92:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R92_92:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R92_92:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 C8 H14
R92_92:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R92_92:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R92_92:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R92_92:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R92_92:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R92_92:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R92_92:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R92_92:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R92_92:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R92_92:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R92_92:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R92_92:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R93_93:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H2 H1 H3 C2
R93_93:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R93_93:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R93_93:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R93_93:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R93_93:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R93_93:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R93_93:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 H6 C4
R93_93:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R93_93:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R93_93:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R93_93:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R93_93:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R93_93:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 H10 C6
R93_93:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R93_93:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R93_93:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 H12 C7
R93_93:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R93_93:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R93_93:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R93_93:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R93_93:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R93_93:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 H17 C9
R93_93:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R93_93:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R93_93:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R93_93:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R93_93:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R93_93:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R93_93:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R93_93:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R93_93:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R94_94:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H2 H3 H1
R94_94:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R94_94:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R94_94:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R94_94:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R94_94:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R94_94:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R94_94:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R94_94:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R94_94:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R94_94:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R94_94:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R94_94:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R94_94:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R94_94:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R94_94:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R94_94:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R94_94:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R94_94:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R94_94:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R94_94:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R94_94:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R94_94:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R94_94:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R94_94:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R94_94:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 C10 H18 H19
R94_94:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R94_94:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R94_94:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H20 H22
R94_94:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R94_94:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R94_94:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R95_95:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C2 H3 H1 H2
R95_95:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R95_95:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R95_95:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R95_95:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R95_95:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R95_95:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R95_95:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H6 H7
R95_95:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R95_95:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R95_95:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R95_95:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R95_95:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R95_95:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H11 C6 H10
R95_95:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R95_95:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R95_95:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 C7 H12 H13
R95_95:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R95_95:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R95_95:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H14 H15
R95_95:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R95_95:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R95_95:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H16 H17
R95_95:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R95_95:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R95_95:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 C10 H19
R95_95:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R95_95:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R95_95:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H22 H20
R95_95:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R95_95:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R95_95:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R96_96:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 C2 H2
R96_96:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R96_96:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R96_96:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R96_96:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H4 H5
R96_96:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R96_96:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R96_96:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H6 C4 H7
R96_96:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R96_96:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R96_96:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R96_96:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R96_96:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R96_96:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H10 H11
R96_96:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R96_96:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R96_96:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R96_96:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R96_96:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R96_96:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R96_96:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R96_96:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R96_96:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R96_96:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R96_96:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R96_96:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R96_96:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R96_96:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R96_96:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H22 H21
R96_96:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R96_96:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R96_96:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R97_97:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 C2 H1
R97_97:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R97_97:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R97_97:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R97_97:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R97_97:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R97_97:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R97_97:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R97_97:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R97_97:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R97_97:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R97_97:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R97_97:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R97_97:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 H11 C6
R97_97:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R97_97:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R97_97:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R97_97:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R97_97:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R97_97:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 C8 H15
R97_97:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R97_97:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R97_97:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R97_97:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R97_97:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R97_97:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R97_97:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R97_97:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R97_97:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H20 H21 H22
R97_97:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R97_97:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R97_97:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R98_98:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H3 H2 C2
R98_98:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R98_98:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R98_98:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R98_98:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H5 C3 H4
R98_98:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R98_98:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R98_98:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R98_98:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R98_98:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R98_98:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 C5 H9 H8
R98_98:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R98_98:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R98_98:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 C6 H11 H10
R98_98:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R98_98:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R98_98:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R98_98:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R98_98:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R98_98:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 C8 H15 H14
R98_98:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R98_98:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R98_98:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H17 C9 H16
R98_98:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R98_98:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R98_98:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H18 H19 C10
R98_98:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R98_98:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R98_98:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H20 H21
R98_98:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R98_98:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R98_98:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R99_99:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H3 H2 H1 C2
R99_99:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R99_99:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R99_99:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R99_99:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 H4 H5 C3
R99_99:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R99_99:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R99_99:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 C4 H7 H6
R99_99:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R99_99:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R99_99:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H8 H9 C5
R99_99:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R99_99:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R99_99:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R99_99:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R99_99:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R99_99:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H12 C7 H13
R99_99:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R99_99:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R99_99:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H15 H14 C8
R99_99:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R99_99:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R99_99:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 C9 H17 H16
R99_99:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R99_99:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R99_99:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 H18 C10
R99_99:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R99_99:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R99_99:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H21 H20 H22
R99_99:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R99_99:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R99_99:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R100_100:C1 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 H1 H2 H3 C2
R100_100:H1 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R100_100:H2 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R100_100:H3 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C1
R100_100:C2 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C1 C3 H5 H4
R100_100:H4 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R100_100:H5 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C2
R100_100:C3 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C2 H7 C4 H6
R100_100:H6 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R100_100:H7 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C3
R100_100:C4 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C3 H9 C5 H8
R100_100:H8 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R100_100:H9 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C4
R100_100:C5 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C4 H10 C6 H11
R100_100:H10 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R100_100:H11 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C5
R100_100:C6 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C5 H13 C7 H12
R100_100:H12 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R100_100:H13 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C6
R100_100:C7 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C6 H14 H15 C8
R100_100:H14 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R100_100:H15 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C7
R100_100:C8 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C7 H16 C9 H17
R100_100:H16 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R100_100:H17 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C8
R100_100:C9 C CT ? 0 0 -0.1200 0 0 8 1.0000 0.0000 C8 H19 C10 H18
R100_100:H18 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R100_100:H19 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C9
R100_100:C10 C CT ? 0 0 -0.1800 0 0 8 1.0000 0.0000 C9 H22 H21 H20
R100_100:H20 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R100_100:H21 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
R100_100:H22 H HC ? 0 0 0.0600 0 0 8 1.0000 0.0000 C10
#end
c4science · Help