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R11301/amons-vitd/frag_72_c00005.sdf
83ee1e954e70master

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frag_72_c00005.sdf
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RDKit 3D
19 18 0 0 0 0 0 0 0 0999 V2000
1.2246 1.2830 0.2955 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2203 0.1836 -0.0943 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1537 0.7406 -0.3622 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2970 0.1548 0.0278 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6010 0.7057 -0.2528 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7483 0.1250 0.1327 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0945 0.7046 -0.2088 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5800 -0.3100 -1.0058 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2595 -0.7781 0.5845 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6348 1.6357 -0.8178 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0139 1.6319 -0.7884 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6496 0.9221 0.7084 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2138 0.8453 0.4728 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3217 2.0296 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9087 1.7968 1.2102 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1881 -0.5733 0.6996 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1917 1.6634 -0.9369 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7420 -0.8071 0.6971 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6701 -0.0165 -0.7989 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 7 1 0
1 13 1 0
1 14 1 0
1 15 1 0
2 8 1 0
2 16 1 0
3 17 1 0
4 9 1 0
5 10 1 0
6 18 1 0
7 11 1 0
7 12 1 0
7 19 1 0
M END
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