COMGENEX-ZINC06872116 MOE2007 3D Structure written by MMmdl. 60 63 0 0 1 0 0 0 0 0999 V2000 1.2960 1.6040 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 3.4840 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 3.8180 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 3.0750 3.2870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.6210 3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 1.2470 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 3.6130 4.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 2.8960 5.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 5.1360 4.7270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6580 5.6360 3.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 5.5240 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 6.9820 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 7.3280 5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 8.6680 6.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 9.6770 5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6430 9.3470 4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 8.0080 4.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 5.4920 6.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 6.5180 6.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 7.1030 5.2530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 6.8450 7.6670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8060 5.9140 8.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 7.4720 8.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 8.8980 8.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 9.0720 7.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 7.7910 7.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 10.0070 8.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 9.7850 9.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 10.8600 9.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 12.1540 8.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 12.3790 8.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 11.3080 8.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 0.5210 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 1.9150 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 2.1130 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 3.8100 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 3.9370 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 3.5250 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 4.8960 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 1.2740 2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 1.1170 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 0.1730 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 1.5410 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 5.2740 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 4.9050 5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 6.5560 6.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 8.9260 6.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 10.7190 5.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 10.1330 4.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 7.7810 3.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 4.9360 6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 7.2720 7.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 7.1930 9.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 8.7900 9.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3040 10.6880 9.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6120 12.9880 9.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 13.3890 8.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 11.4980 7.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 1.9760 0.9260 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7060 1.6680 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 59 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 6 59 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 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 46 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 2 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 51 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 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END