IBS-ZINC02226326 MOE2007 3D Structure written by MMmdl. 38 39 0 0 0 0 0 0 0 0999 V2000 1.0000 0.1330 5.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 1.2240 4.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 1.6700 3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 1.0280 2.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -0.0720 3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.5150 4.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 1.4910 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 0.7800 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 1.2250 -1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 0.7670 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -0.3870 -2.6590 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.3950 -3.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 1.1480 -4.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 2.0050 -5.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 1.7330 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 0.8340 -8.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 0.9970 -9.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.4620 -10.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 1.9610 -9.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.2130 5.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 1.7280 4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 2.5190 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -0.5920 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 -1.3680 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 2.5770 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 1.3180 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.3040 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 0.9740 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 1.9250 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 2.0760 -3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 1.3540 -5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 0.0830 -5.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 1.8080 -5.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 3.0690 -5.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 0.0870 -8.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 2.3080 -10.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 2.4140 -7.9730 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6460 3.1580 -7.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 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 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 36 1 0 0 0 0 19 37 2 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 37 1 M END