KEYORGANICS-ZINC03135061 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 -2.0380 -2.3370 4.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -1.8200 3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -1.6020 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -1.1530 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 -0.9220 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -1.1320 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -1.6010 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 -0.8680 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 0.0920 -0.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -0.1750 -0.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 -1.3260 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 -1.2280 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8390 -0.0280 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1570 1.1250 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 1.0090 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 1.3720 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 2.0900 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.4400 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 3.1370 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 3.4690 0.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 3.1560 1.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 2.4750 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1460 2.1210 2.8760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -8.5600 0.0900 -1.0670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.9870 -2.6520 -1.7420 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0560 -3.4310 4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -2.0040 5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -1.9650 4.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -1.7820 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -0.9850 2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -0.5730 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8350 -1.7910 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -1.8100 -1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.4490 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2180 -2.2420 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 2.0550 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 2.1790 -1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 3.4200 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 4.0150 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 1.9280 -0.0280 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0150 2.8880 0.2460 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 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 40 1 0 0 0 0 16 17 1 0 0 0 0 16 40 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 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END