COMGENEX-ZINC06705800 MOE2007 3D Structure written by MMmdl. 57 60 0 0 1 0 0 0 0 0999 V2000 7.0010 5.7810 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0790 6.3390 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 6.0370 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 6.9650 -1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 6.8010 -1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 5.6910 -1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 4.7270 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 4.9000 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2130 3.7980 0.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 2.9720 0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 3.5150 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 2.9420 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0760 3.5530 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 1.5050 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7440 1.0050 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.7350 -1.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 3.1670 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 2.1630 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 2.4210 3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 3.6840 3.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 4.6870 2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 4.4360 1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 5.9690 3.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 6.1160 3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 5.4240 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0210 5.6500 4.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 6.5750 5.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 7.2830 5.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 7.0580 4.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 3.4710 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6060 4.0340 2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0450 5.9900 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8870 4.6980 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7930 6.2370 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2200 7.4260 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3660 5.9630 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 7.8450 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 7.5350 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 5.5690 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1920 2.0620 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 0.8170 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 1.4720 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 1.1630 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5570 1.6300 4.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 3.8750 4.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 5.2400 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7940 4.7160 2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 5.1070 3.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 6.7510 5.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 8.0100 6.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 7.6130 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5650 2.3780 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2950 3.8080 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5860 3.7940 3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4830 5.1220 2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 3.6100 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -0.0990 -0.2460 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 57 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 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M CHG 1 57 -1 M END