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R11301/amons-vitc/amons/frag_50_c00001.sdf
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frag_50_c00001.sdf
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RDKit 3D
17 16 0 0 0 0 0 0 0 0999 V2000
-0.3297 -0.3523 0.5627 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4879 -0.7441 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7693 -2.1282 -0.1566 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7831 -0.0318 -0.0132 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4078 0.9101 0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1521 2.1398 0.2982 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7245 0.6964 -0.0543 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6757 -0.2636 1.5906 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2367 -0.5974 -1.4112 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0468 -2.6365 -0.5718 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6074 -0.4334 -0.6129 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0568 -0.1945 1.0369 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0207 2.0729 0.7588 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3736 -1.1970 0.5969 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7137 1.0393 -0.1977 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1427 -0.2938 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3774 1.5237 -0.2577 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
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5 7 2 3
1 8 1 0
1 14 1 0
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4 11 1 0
4 12 1 0
4 15 1 0
6 13 1 0
7 16 1 0
7 17 1 0
M END
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