IBS-ZINC02409916 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -4.1230 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -4.6300 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -4.8540 -1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -4.6360 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -5.3400 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7770 -5.5810 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0090 -6.0330 -0.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2040 -6.0940 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 -5.6720 -2.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9460 -5.6050 -3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3470 -5.6140 -4.1930 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8400 -4.6640 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1730 -6.7560 -3.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3350 -6.5100 -2.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.5620 -6.6860 -1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6740 -6.4430 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8880 -6.6180 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9920 -7.0350 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8850 -7.2780 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6750 -7.0990 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3160 -7.2260 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2280 -5.8160 -5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0730 -5.3320 1.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8090 -4.8700 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2050 -4.6620 2.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 -5.5760 2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -4.4740 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.4840 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -4.6880 -3.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 -6.4680 -3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1530 -6.7890 -4.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6560 -7.7030 -3.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8110 -6.1180 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9750 -6.4300 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7490 -7.6040 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5930 -7.2830 -3.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8780 -6.2920 0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8830 -8.0060 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1430 -7.5170 1.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7330 -6.7660 -5.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2230 -5.8220 -6.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -5.0030 -6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5030 -6.6010 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 -4.8840 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7790 -5.4240 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 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 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 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 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 2 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 M END