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R11301/amons-vitd/frag_052_c00001.sdf
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frag_052_c00001.sdf
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RDKit 3D
17 16 0 0 0 0 0 0 0 0999 V2000
-6.6370 -0.6916 -2.1170 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3364 0.1819 0.0114 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5214 0.7016 -0.2518 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7864 0.0513 0.1775 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0957 0.7073 -0.2116 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7783 -1.0911 0.8559 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0612 -0.3269 -0.8071 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7356 -1.0520 -2.0359 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1289 -0.7615 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6198 1.6441 -0.8015 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9685 1.5167 -0.9404 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5364 1.1471 0.6917 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0468 0.1263 -0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4289 0.7002 -0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7110 -1.5682 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8854 -1.6583 1.1708 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1954 -1.2392 -0.2101 H 0 0 0 0 0 0 0 0 0 0 0 0
1 7 1 0
2 3 2 3
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4 5 1 0
4 6 2 3
5 7 1 0
1 8 1 0
2 9 1 0
2 14 1 0
3 10 1 0
5 11 1 0
5 12 1 0
6 15 1 0
6 16 1 0
7 13 1 0
7 17 1 0
M END
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