fragmenstein/demo/mac1_mols/mac-x0212.mol
mac-x0212
RDKit 3D
14 14 0 0 0 0 0 0 0 0999 V2000
-6.5720 12.8250 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9640 14.5840 0.9280 S 0 0 2 0 0 0 0 0 0 0 0 0
-7.7890 15.0190 2.0260 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.5380 14.7550 -0.3410 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.5570 15.4920 0.9730 N 0 0 0 0 0 0 0 0 0 0 0 0
-4.5680 15.2250 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8790 15.5370 -1.3660 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9590 15.2390 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7400 14.7180 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4420 14.4400 -0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3480 14.6650 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7310 14.3590 -3.0920 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6540 13.8250 -2.8400 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0480 14.5110 -4.2820 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 1
2 3 2 0
2 4 2 0
2 5 1 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
9 10 1 0
6 11 1 0
10 11 2 0
9 12 1 0
12 13 2 0
12 14 1 0
M END