IBS-ZINC04483022 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.4060 1.2550 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.1840 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -1.1930 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -2.5130 0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -2.8240 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -1.8140 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -0.4940 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 -4.5060 -1.3200 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -4.5550 -2.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -5.2840 -0.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -4.8860 -0.8790 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 -4.6900 -1.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -5.9930 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -6.7040 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -5.4320 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 -7.5520 -0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -7.7900 0.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -7.0740 1.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7420 -8.7990 1.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 -9.0200 2.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 -10.0580 2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9310 -11.2320 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 -11.3550 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 -12.4750 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -13.4280 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8230 -13.2860 0.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.8930 -12.2410 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 1.5440 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 1.8910 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 1.3720 1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.9500 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -3.3010 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9320 -2.0570 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.2940 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 -3.8850 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 -4.4420 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -5.8330 -2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -6.7720 -2.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -7.4720 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -7.0620 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -5.6740 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 -4.6990 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -8.4380 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1210 -7.3440 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0050 -9.3710 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6930 -10.0630 3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -10.5960 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -12.6040 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8260 -14.3030 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7050 -12.1630 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -6.4040 -0.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 51 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 46 1 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 27 50 1 0 0 0 0 M END