COMGENEX-ZINC06688364 MOE2007 3D Structure written by MMmdl. 63 66 0 0 1 0 0 0 0 0999 V2000 2.2430 6.7910 4.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 6.1480 3.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 5.5170 4.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 6.3110 2.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 7.0990 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 7.4670 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 6.2370 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 5.7030 1.5770 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6280 6.0430 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 4.1630 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 3.5880 1.8450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 3.4280 1.2120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 1.9690 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 1.3150 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9380 -0.7840 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -2.3090 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -2.8480 0.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.3590 -0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -0.8390 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 3.9960 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 4.0000 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 4.1500 3.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1210 4.0720 3.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5880 4.1460 5.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 4.0280 5.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8580 3.8320 4.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 3.7530 2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0360 3.8830 2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 3.8720 1.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 3.7450 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 7.8770 4.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 6.4340 5.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 6.5260 4.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 6.4560 1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 7.9760 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 7.7120 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 8.3330 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 5.5040 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 6.4850 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 1.5640 1.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.7420 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 1.6010 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 1.6040 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -0.4600 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.3790 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -2.6320 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -2.7340 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -2.6790 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -2.8230 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.4560 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -0.5200 -1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 5.0130 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 3.3850 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 4.2900 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 4.2990 5.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 4.0900 6.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9210 3.7410 4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 3.6030 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9510 4.0360 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3730 4.4100 -0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 2.7030 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -0.2030 0.2400 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8930 -0.4720 0.4140 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 62 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 62 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 62 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 55 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 26 27 2 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END