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R11301/amons-vitd/frag_70_c00002.sdf
83ee1e954e70master

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frag_70_c00002.sdf
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RDKit 3D
21 20 0 0 0 0 0 0 0 0999 V2000
1.2515 1.2111 0.2707 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5401 0.3996 0.5297 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1520 0.1959 -0.1324 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4562 2.2448 -0.8409 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6340 1.1363 1.2792 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2167 0.7529 -0.3818 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3427 0.1650 0.0551 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9331 0.0056 -0.4132 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4737 -0.3342 -1.0407 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6770 1.7674 -1.7993 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2773 2.9212 -0.6107 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2849 1.5015 2.2478 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3178 -0.7518 0.6302 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9482 1.7317 1.1908 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2792 -0.4764 1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0855 -0.5667 0.6578 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5662 2.8707 -0.9762 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4751 0.4465 1.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0215 1.9803 0.7003 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3059 1.6483 -0.9962 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3181 0.5847 -0.1918 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
2 5 1 0
3 6 1 0
6 7 2 3
1 14 1 0
2 8 1 0
2 15 1 0
3 9 1 0
3 16 1 0
4 10 1 0
4 11 1 0
4 17 1 0
5 12 1 0
5 18 1 0
5 19 1 0
6 20 1 0
7 13 1 0
7 21 1 0
M END
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