IBS-ZINC02134740 MOE2007 3D CORINA 3.40 0006 02.08.2006 83 87 0 0 1 0 0 0 0 0999 V2000 -0.2560 1.5500 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 0.0250 -0.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4670 -0.3550 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.7410 1.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -1.7790 1.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -2.2240 2.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -1.2550 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.4680 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -0.0930 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5700 -0.5840 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.0140 -2.6210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3010 1.1120 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -0.4710 -1.3600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4500 -1.5710 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -0.1050 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 -0.5650 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -1.1490 -3.6220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6510 -0.2240 -3.8550 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0180 0.7660 -4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.8970 -5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -1.3540 -5.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 -1.2650 -5.0560 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2360 -0.0740 -5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0480 0.9910 -4.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 -0.2050 -6.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9470 1.0780 -6.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 1.1330 -7.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2240 0.1410 -8.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6430 2.4310 -7.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7000 2.2210 -8.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 3.5190 -9.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1180 4.5140 -8.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4000 3.5740 -10.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1000 4.8360 -10.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1410 4.6280 -11.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8080 4.8150 -12.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7560 4.6280 -13.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0540 4.2480 -13.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3830 4.0620 -12.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4270 4.2580 -11.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0740 4.0450 -14.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7850 4.2080 -15.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 -2.4670 -5.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 -2.5750 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 1.9420 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 1.8880 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 1.9080 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -0.3210 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 0.3810 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -2.4970 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -1.9360 2.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -1.5130 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -0.5950 -1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 0.9810 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -1.6700 -2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -0.2540 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 0.9830 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -0.5560 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 0.2960 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -1.3200 -2.2890 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0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 67 1 0 0 0 0 29 68 1 0 0 0 0 30 31 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 71 1 0 0 0 0 34 35 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 35 36 1 0 0 0 0 35 40 2 0 0 0 0 36 37 2 0 0 0 0 36 74 1 0 0 0 0 37 38 1 0 0 0 0 37 75 1 0 0 0 0 38 39 2 0 0 0 0 38 41 1 0 0 0 0 39 40 1 0 0 0 0 39 76 1 0 0 0 0 40 77 1 0 0 0 0 41 42 2 0 0 0 0 41 82 1 0 0 0 0 43 78 1 0 0 0 0 44 79 1 0 0 0 0 44 80 1 0 0 0 0 44 81 1 0 0 0 0 82 83 1 0 0 0 0 M END