fragmenstein/demo/test_mols/x0032_0A.mol
RDKit 3D
17 19 0 0 0 0 0 0 0 0999 V2000
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6.9650 17.1960 -0.9620 C 0 0 1 0 0 0 0 0 0 0 0 0
6.0800 16.8190 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2420 15.3690 -2.5710 C 0 0 0 0 0 0 0 0 0 0 0 0
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7.8460 13.7480 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6590 14.0480 -4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0
10.0200 14.1520 -4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3810 14.5520 -5.9870 N 0 0 0 0 0 0 0 0 0 0 0 0
9.2490 14.7660 -6.7340 C 0 0 0 0 0 0 0 0 0 0 0 0
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7.8220 15.3340 -8.5350 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7070 15.0340 -7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8480 14.6150 -6.4410 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1390 14.4710 -5.9120 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4340 15.2290 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3850 16.6780 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 6
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9 8 1 0
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11 10 2 0
12 11 1 0
13 12 2 0
14 13 1 0
15 14 2 0
15 10 1 0
15 7 1 0
16 5 1 0
17 16 1 0
17 2 1 0
M END