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R11301/amons-vitd/frag_057_c00001.sdf
d882c03886a3master

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frag_057_c00001.sdf
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RDKit 3D
21 20 0 0 0 0 0 0 0 0999 V2000
1.2188 1.2500 0.2869 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5087 0.4544 0.5643 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1655 0.1953 -0.1077 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4263 2.2682 -0.8575 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2013 0.7238 -0.3791 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8229 2.0394 1.5554 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3075 0.1550 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7740 -0.1483 -0.3175 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5330 -0.3235 -1.0038 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6129 1.7629 -1.8106 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2526 2.9567 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0796 2.6502 1.4038 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6194 1.3741 2.4016 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6118 2.7380 1.8745 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3031 -0.7703 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3409 -0.2682 1.3808 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3571 1.0785 0.8234 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1394 -0.5690 0.6825 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5352 2.9019 -1.0121 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2482 1.6347 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2656 0.5878 -0.2278 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
1 3 1 0
1 4 1 0
1 6 1 0
3 5 1 0
5 7 2 3
2 8 1 0
2 16 1 0
2 17 1 0
3 9 1 0
3 18 1 0
4 10 1 0
4 11 1 0
4 19 1 0
5 20 1 0
6 12 1 0
6 13 1 0
6 14 1 0
7 15 1 0
7 21 1 0
M END
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