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mol.mol
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OpenBabel07172223023D
40 37 0 0 1 0 0 0 0 0999 V2000
11.6160 24.0440 0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0
10.3870 24.2380 0.8350 C 0 0 2 0 0 0 0 0 0 0 0 0
10.5530 25.1630 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6640 25.4060 2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0
9.8590 22.8820 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7590 22.1950 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9880 20.7250 3.0230 S 0 0 0 0 0 0 0 0 0 0 0 0
8.8320 21.4890 4.1710 C 0 0 0 0 0 0 0 0 0 0 0 0
12.4780 24.0100 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4230 25.6300 2.5630 N 0 0 0 0 0 0 0 0 0 0 0 0
9.3790 26.4240 3.7900 C 0 0 2 0 0 0 0 0 0 0 0 0
8.5570 25.6940 4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5330 25.0830 4.5700 O 0 0 0 0 0 0 0 0 0 0 0 0
8.7420 27.8080 3.5140 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4720 28.5360 4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6610 28.6310 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0520 25.6990 6.1070 N 0 0 0 0 0 0 0 0 0 0 0 0
8.3260 25.1520 7.2610 C 0 0 2 0 0 0 0 0 0 0 0 0
7.8290 26.3140 8.1310 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6340 27.1110 8.6160 O 0 0 0 0 0 0 0 0 0 0 0 0
9.2680 24.2650 8.0850 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8460 22.9180 8.6690 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0420 22.1160 7.6620 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1060 22.1600 9.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9440 26.0730 6.2530 H 0 0 0 0 0 0 0 0 0 0 0 0
13.7370 25.7570 4.5480 N 0 0 0 0 0 0 0 0 0 0 0 0
13.7770 26.9990 5.3130 C 0 0 2 0 0 0 0 0 0 0 0 0
12.9150 26.8730 6.5660 C 0 0 0 0 0 0 0 0 0 0 0 0
11.7420 26.5230 6.4970 O 0 0 0 0 0 0 0 0 0 0 0 0
13.2960 28.1670 4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0
14.2230 28.5260 3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0
13.4860 29.4050 2.2890 C 0 0 0 0 0 0 0 0 0 0 0 0
15.4510 29.2360 3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0
13.0930 25.6580 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0510 25.0850 0.8650 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0710 25.7230 2.1780 C 0 0 2 0 0 0 0 0 0 0 0 0
4.1620 24.9340 3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9500 24.9220 2.9460 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5930 27.1570 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2000 24.9980 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0
1 9 1 0 0 0 0
1 2 1 0 0 0 0
2 5 1 1 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
3 10 1 0 0 0 0
5 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
11 10 1 6 0 0 0
11 12 1 0 0 0 0
12 17 1 0 0 0 0
13 12 2 0 0 0 0
14 11 1 0 0 0 0
14 15 1 0 0 0 0
16 14 1 0 0 0 0
17 25 1 0 0 0 0
17 18 1 0 0 0 0
18 21 1 1 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
21 22 1 0 0 0 0
22 24 1 0 0 0 0
23 22 1 0 0 0 0
26 27 1 0 0 0 0
27 30 1 6 0 0 0
27 28 1 0 0 0 0
29 28 2 0 0 0 0
31 33 1 0 0 0 0
31 30 1 0 0 0 0
32 31 1 0 0 0 0
34 26 1 0 0 0 0
35 36 1 0 0 0 0
36 39 1 6 0 0 0
36 37 1 0 0 0 0
38 37 2 0 0 0 0
40 35 1 0 0 0 0
M END