COMGENEX-ZINC04720424 MOE2007 3D Structure written by MMmdl. 57 60 0 0 1 0 0 0 0 0999 V2000 2.9820 5.7840 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 4.3610 2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 3.5750 1.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 2.2620 1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 1.7670 2.5530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 1.5490 0.9920 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 2.1240 0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 1.3160 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 -0.1230 0.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -0.6950 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 0.1230 0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -0.8060 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -0.2480 -1.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -2.3050 -0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -2.8790 -2.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2980 -2.4420 -2.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 -2.5110 -3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -3.1140 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.7380 -5.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -1.7500 -5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -1.1360 -5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -1.5130 -4.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -4.3670 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 -5.3620 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -6.3470 -2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5920 -5.0460 -2.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5800 -4.5350 -3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 -5.4060 -3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4250 -6.8300 -3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -7.2990 -2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 6.4250 3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0610 6.1950 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 5.8120 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 3.9570 3.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 4.3460 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 2.0910 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 3.1710 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 1.7110 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 1.4180 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -0.6710 1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -1.7390 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -0.2580 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 0.0190 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.4910 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -2.7850 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -3.8740 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -3.2130 -5.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -1.4520 -6.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -0.3570 -6.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 -0.9990 -3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -5.3680 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -3.4750 -3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2760 -5.0630 -4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -7.4830 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -8.3450 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -6.5660 -1.5250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1930 -7.4730 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 51 1 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 25 56 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END