IBS-ZINC05025090 MOE2007 3D Structure written by MMmdl. 35 36 0 0 0 0 0 0 0 0999 V2000 1.2230 0.5460 -5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 0.9710 -3.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 1.7070 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 1.0510 -2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 0.1110 -3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.3610 -4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 1.5320 -1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 0.8910 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 1.1060 1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 1.8430 2.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 2.2220 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 3.0320 4.8720 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.9370 3.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.1970 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 0.0250 -5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 1.4380 -5.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 0.0830 -3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 1.6160 -4.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 2.7340 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 1.7780 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -0.3500 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -1.3770 -4.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -0.4250 -5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 1.3090 -1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 2.6250 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -0.1910 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 1.0700 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9010 1.3790 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3760 0.0300 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 2.0800 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 2.2480 4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 0.1240 2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.5330 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.4910 1.1890 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8940 2.5130 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 34 1 M END