KEYORGANICS-ZINC01397536 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 -0.7300 1.5670 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 1.1810 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 1.5520 1.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 1.1790 2.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 1.9830 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 3.2710 2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 3.7840 3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 3.0120 4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.7090 5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 1.2340 4.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.0090 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -1.1150 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 -1.0950 3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0630 -2.2010 2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -3.2970 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -3.3540 1.8820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -2.2660 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.4270 1.8040 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 3.5740 5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8890 5.1770 3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 2.6470 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 1.2920 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6970 1.0550 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 0.1030 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.6780 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 2.6290 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 1.0570 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 3.8390 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 1.0990 5.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -0.2250 3.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -2.2090 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0170 -4.1850 1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5100 4.4770 6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 2.8580 6.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 3.8070 5.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 5.8210 4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9670 5.1490 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 5.6340 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.0270 4.1380 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8890 -0.7380 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 39 2 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 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END