IBS-ZINC05208965 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 0.0350 1.2260 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 1.3510 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 3.2130 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 3.5800 0.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3530 3.1300 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 5.1010 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 5.4470 -1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 5.5810 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9530 5.4520 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 5.6580 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 5.9920 -1.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 6.1220 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 5.9190 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 5.9760 -3.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 5.7040 -2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 5.6760 -2.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 4.9390 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 4.9170 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 5.6220 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 6.3560 -4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 6.3820 -3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 7.2390 -5.6710 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 3.0910 0.4550 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.1380 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 1.6130 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 1.5380 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0310 1.7960 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 0.2650 2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 1.6940 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 3.6610 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 3.5880 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 5.5450 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 5.4830 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 5.1920 0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0540 5.5580 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6010 6.1500 -2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 6.3820 -3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 4.3880 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 4.3470 -1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 5.6010 -3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 6.9510 -4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 3.4510 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6550 1.7530 1.4120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 43 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 23 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 23 42 1 0 0 0 0 M END