IBS-ZINC02118550 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.2420 1.3620 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.1150 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -0.7630 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -2.1440 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 -2.9210 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.2290 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.8810 -1.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -2.9750 -2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -4.1950 -2.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -2.1690 -3.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.6830 -4.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -1.6230 -5.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -2.1270 -7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -3.6530 -6.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -3.1570 -5.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -2.9470 -9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -3.0260 -9.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -1.8560 -9.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -1.9290 -10.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0900 -3.1690 -10.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 -4.3370 -10.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -4.2680 -9.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -2.4510 2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.6460 3.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.5920 4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -2.3750 5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -1.1780 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 -1.2490 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.2510 2.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.7290 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 1.8870 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.6330 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 1.6980 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -3.9980 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -1.1720 -3.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -3.5440 -4.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.7110 -5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -1.3370 -5.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.3260 -7.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -2.9870 -7.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -4.5310 -6.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -3.8960 -6.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -3.9610 -4.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -2.3380 -5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -3.8950 -9.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.1820 -9.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -0.8760 -9.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -1.0190 -10.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 -3.2250 -10.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 -5.3030 -10.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -5.1940 -9.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -4.6010 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -4.5120 5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -2.3540 6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.2310 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 -2.5640 -7.6350 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5140 -1.7510 -7.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 14 56 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END