IBS-ZINC06661985 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 -0.6290 2.5400 1.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 1.0290 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.0500 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 -1.6580 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -1.4040 1.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 -0.0270 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 0.5170 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6130 -2.4230 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 -2.1760 2.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 -1.2850 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 -3.1760 3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -2.9720 4.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1870 -4.4560 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -4.6440 1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -3.6250 1.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -6.0070 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0560 -5.6020 3.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3410 -5.5980 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4530 -6.3640 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6320 -6.3600 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6990 -5.5900 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5880 -4.8250 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4110 -4.8330 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9840 -5.5850 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1280 -6.0800 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2850 -4.1620 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 3.0320 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 2.9120 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 2.7520 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 0.8170 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 0.6570 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -1.5850 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -1.1320 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -1.1940 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -2.7320 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3700 0.5930 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 -0.0230 2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 1.5720 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -0.0400 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7520 -6.1380 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -6.0940 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2150 -6.7740 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5320 -6.5430 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -5.4930 4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6190 -6.9650 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7180 -6.9570 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4220 -4.2240 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3250 -4.2380 3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8830 -6.2420 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2290 -5.4230 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0570 -6.0770 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9130 -7.0940 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4700 -3.8090 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2150 -4.1580 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3860 -3.5050 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 0.3660 1.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 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 M END