IBS-ZINC02198740 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.7570 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -2.1870 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -3.5340 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -3.9460 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -5.1100 -1.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 -5.8190 -2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3310 -5.5210 -1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9610 -6.3270 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 -6.4570 -1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1940 -7.1370 -0.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7460 -7.7020 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6250 -8.4300 1.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1620 -9.0010 2.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8250 -8.8760 3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9470 -8.1790 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3870 -7.5750 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5310 -6.8880 0.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -5.7740 -2.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3320 -5.2210 -2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1520 -4.4780 -3.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7190 -5.6610 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3200 -4.4200 -3.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5060 -4.3100 -3.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0960 -5.4380 -4.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4990 -6.6780 -4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3090 -6.7900 -3.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2560 -5.3290 -5.0200 F 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.6620 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.5050 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -2.2820 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.4390 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -3.4400 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.2830 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -3.3820 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6630 -8.5360 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8410 -9.5580 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 -9.3380 4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 -8.0900 2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -4.1190 -3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 -4.3110 -4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8600 -3.5400 -2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9740 -3.3440 -3.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9610 -7.5570 -4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8410 -7.7560 -3.3720 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 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 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 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 2 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END