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R11301/amons-vitd/frag_046_c00003.sdf
b3236b2c31ffmaster

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frag_046_c00003.sdf
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RDKit 3D
18 17 0 0 0 0 0 0 0 0999 V2000
1.2572 1.1585 0.3053 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5689 0.4341 0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1851 0.1715 -0.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1733 0.7797 -0.3905 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2272 2.0831 -1.1574 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3077 0.1844 0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9060 -0.1292 -0.2824 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4968 -0.3353 -1.0474 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8354 2.9037 -0.5468 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2521 2.3448 -1.4674 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2757 -0.7543 0.5675 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4471 1.8866 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9473 1.7041 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4362 -0.2843 1.4239 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3593 1.1491 0.8813 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0796 -0.6047 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6159 2.0022 -2.0656 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2891 0.6045 -0.1683 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
1 3 1 0
3 4 1 0
4 5 1 0
4 6 2 3
1 12 1 0
1 13 1 0
2 7 1 0
2 14 1 0
2 15 1 0
3 8 1 0
3 16 1 0
5 9 1 0
5 10 1 0
5 17 1 0
6 11 1 0
6 18 1 0
M END
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