IBS-ZINC02209658 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -2.8750 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7150 -3.5570 1.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9120 -5.0120 1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4760 -5.4450 0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3990 -5.2370 1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4250 -6.1270 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5780 -5.3960 1.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.4740 -5.7680 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3010 -4.1400 1.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9960 -3.9560 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9150 -2.9530 1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0860 -1.7500 1.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3150 -7.6020 1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7830 -8.3330 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6770 -9.7090 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1100 -10.3670 1.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 -9.6530 2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7360 -8.2710 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2720 -7.5680 3.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -5.6240 2.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 -6.8250 2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -7.3870 3.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 -6.7480 4.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 -5.5470 5.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3800 -4.9820 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -7.4540 6.3670 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -2.0080 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -3.5830 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 -3.4950 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5070 -1.9210 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2270 -7.8230 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0400 -10.2740 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0310 -11.4440 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2010 -10.1730 3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9310 -7.4260 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 -7.3230 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 -8.3250 3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -5.0470 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9070 -4.0420 4.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 29 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 M END