&maincard ntypes=6 perub=789.9,110.004,18.64 perlb=-0.5,-0.5,-0.5 ilatseed=21 amass=69.72,14.00674,69.72,14.00674,69.72,14.00674,69.72,14.00674 ielement=31,7,31,7,31,7,31,7 iseed=212121 &end &latcard lattype='sc' alat=5.2,5.5252,3.19 xrot=1.0 0.0 0.0 yrot=0.0 1.0 0.0 zrot=0.0,0.0,1.0 periodicity=1.0,1.0,1.0 strain=0.0,0.0,0.0 delx=0.0,0.0,0.0 &end &subcard rcell=0.0,0.0,0.0 ccell=1.0,0.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.0,0.5,0.5 ccell=1.0,0.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.5,0.33333333,0.0 ccell=1.0,0.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.5,0.83333333,0.5 ccell=1.0,0.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.375,0.0,0.0 ccell=0.0,1.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.375,0.5,0.5 ccell=0.0,1.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.875,0.33333333,0.0 ccell=0.0,1.0,0.0,0.0,0.0,0.0 &end &subcard rcell=0.875,0.83333333,0.5 ccell=0.0,1.0,0.0,0.0,0.0,0.0 &end &subcard &end &defcard plane=0.0,2.0,0.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=1 newtype=3 &end &defcard plane=0.0,-2.0,0.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=1 newtype=3 &end &defcard plane=0.0,1.0,-1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=1 newtype=3 &end &defcard plane=0.0,-1.0,1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=1 newtype=3 &end &defcard plane=0.0,-1.0,-1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=1 newtype=3 &end &defcard plane=0.0,1.0,1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=1 newtype=3 &end &defcard plane=0.0,2.0,0.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=2 newtype=4 &end &defcard plane=0.0,-2.0,0.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=2 newtype=4 &end &defcard plane=0.0,1.0,-1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=2 newtype=4 &end &defcard plane=0.0,-1.0,1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=2 newtype=4 &end &defcard plane=0.0,-1.0,-1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=2 newtype=4 &end &defcard plane=0.0,1.0,1.0 cent=0.0,53.41,9.57 dist=2.762621 oldtype=2 newtype=4 &end &defcard oldtype=4 newtype=2 prob=1.0 &end &defcard oldtype=3 newtype=1 prob=1.0 &end &defcard &end &latcard &end &hitcard &end &disturbcard dismax=0.0 strain=0.0,0.0,0.0 &end &shiftcard mode=2 &end &velcard Tmid=300 Tbnd=300 naxis=1 nmesh=40 equal=2.0 ensureTave=1.0 steeper=0.0 &end &filecard dynamo="none" paradyn="none" lammps="rout" xyz="none" &end