KEYORGANICS-ZINC01383362 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 -0.4580 -1.5760 6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -1.5420 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 -1.8560 4.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -1.8520 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -1.5380 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -1.2550 2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -1.2570 3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -1.5100 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -0.5290 0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -0.8170 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -2.0200 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1080 -1.9390 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -0.6830 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 0.5220 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 0.4090 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6590 0.8020 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 1.5530 0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.7060 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 2.4460 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 3.0080 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 2.8870 2.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 2.1610 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0530 3.9300 1.9320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.2450 -0.6130 -1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -3.2230 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -2.5820 6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -0.8700 6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -1.2910 6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -2.1060 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3830 -2.0950 2.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -1.0230 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.0320 4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0160 -2.5080 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -1.2330 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -2.9660 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5850 1.4910 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.2600 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 2.5780 -0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 2.0730 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8430 -1.1600 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6070 0.4210 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -1.0330 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6720 -3.3530 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 -3.2170 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1920 -4.0960 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 1.3740 0.0860 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0120 2.3730 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 46 2 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 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END