COMGENEX-ZINC04796639 MOE2007 3D Structure written by MMmdl. 40 40 0 0 0 0 0 0 0 0999 V2000 1.3330 6.4310 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 5.1780 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 3.7650 1.8510 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 3.9590 0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 3.4460 3.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 2.6810 1.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 1.3740 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 0.7690 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -0.5780 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -1.3380 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -0.7230 0.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 0.6220 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -2.7730 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -4.2940 -1.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -4.3060 -3.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -3.7170 -4.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -5.7410 -3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 7.2840 2.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 6.6670 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 6.3090 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 4.9470 2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 5.3080 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 1.3130 1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -1.0220 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -1.2790 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0900 1.0850 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -3.3420 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -3.2490 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -4.8110 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -4.7540 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -3.7110 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8320 -2.6530 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -4.2350 -4.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -3.8060 -5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -6.1660 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -5.7700 -4.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -6.3860 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.8910 -1.3330 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9730 -2.4260 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -2.3470 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 38 1 M END