COMGENEX-ZINC06689060 MOE2007 3D Structure written by MMmdl. 47 48 0 0 0 0 0 0 0 0999 V2000 -1.3810 2.9690 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 2.9480 -2.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 2.0070 -1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 2.0240 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 1.3950 0.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 2.1950 0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 2.5010 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 2.1180 4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 3.4650 4.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 3.6900 3.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 5.0090 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 5.1410 1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 5.6870 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9810 5.8300 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 5.4360 0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0020 4.9060 1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 4.7660 2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 4.4170 2.7650 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 0.0920 0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.3100 1.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.7920 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -2.1380 0.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -2.9710 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 3.7050 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 3.2640 -4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 1.9890 -3.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 2.2990 -2.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0060 -2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 3.0520 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 1.5050 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 3.1470 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 1.6310 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 1.4710 5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 4.3080 5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 5.7950 3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 5.1140 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 6.0000 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0710 6.2510 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1010 5.5490 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 4.3550 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -0.7630 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -0.3920 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -2.6230 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -3.9860 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -2.9920 -0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.5660 3.3610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7990 0.5680 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 10 1 0 0 0 0 7 46 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 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 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END