KEYORGANICS-ZINC04002575 MOE2007 3D Structure written by MMmdl. 43 46 0 0 0 0 0 0 0 0999 V2000 -5.5480 2.1210 -4.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 1.4870 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 2.0210 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0470 3.2150 -2.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1290 3.8370 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 3.3210 -4.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 5.0820 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 4.0240 -1.3390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 3.7540 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 3.4320 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 2.3910 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 2.1000 -0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 2.8430 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 3.8770 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 4.1620 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 4.8480 2.1300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 2.4370 0.3520 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 6.1910 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 7.0130 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 8.1280 -1.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 7.9760 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 9.0520 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 10.2830 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 10.4460 -2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6050 9.3690 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 11.6070 -0.5960 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 1.6660 -4.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 0.5560 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 1.5290 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 3.8190 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 2.9160 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0910 4.6360 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4270 1.7940 -1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 1.2880 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 4.9630 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 6.3530 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 6.8970 -3.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 7.0180 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 8.9180 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 11.4040 -2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 9.5140 -3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3650 4.9760 -3.2970 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2450 5.6520 -4.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 42 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END