COMGENEX-ZINC06765352 MOE2007 3D Structure written by MMmdl. 45 47 0 0 0 0 0 0 0 0999 V2000 -0.1940 11.6500 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 11.1210 1.6870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 10.0250 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 9.4640 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 10.3010 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 9.7240 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 8.3820 -2.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 7.6350 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6690 8.1240 0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 5.8730 -1.4700 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 5.3030 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 3.8040 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 2.9630 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 1.5780 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 1.0190 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 1.8320 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 3.2270 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7230 1.2300 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 2.0450 -0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 10.4830 -3.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 11.9310 -3.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 12.1950 -4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 11.0510 -5.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 9.8660 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 12.0190 3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 12.4860 3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 10.8900 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 9.2420 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 10.3630 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 11.3750 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 5.7820 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 5.6010 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 3.3830 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 0.9300 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -0.0630 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 3.8650 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 12.3230 -2.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 12.4010 -3.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 13.1790 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 12.1330 -5.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 11.2670 -5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 10.8690 -6.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 9.1440 -4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 9.3680 -4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 -0.0380 0.0650 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M CHG 1 45 -1 M END