IBS-ZINC02440710 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.8190 0.0780 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -1.2630 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -1.1190 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -1.4510 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3200 -1.3190 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 -0.8540 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -0.5200 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 -0.6460 -1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -0.3040 -2.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -0.5250 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2910 -0.9440 -3.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.2500 -4.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -0.5680 -5.9710 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3950 -1.7310 -6.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -1.6440 -7.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -0.3820 -7.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 0.2420 -6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8330 1.6370 -6.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 1.6040 -7.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9290 0.4870 -8.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -2.6950 -8.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -3.9640 -8.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -4.9410 -9.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4700 -4.6640 -10.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 -3.4040 -10.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 -2.4230 -9.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8240 -5.6300 -11.2480 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -5.2780 -12.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -0.0270 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 0.8300 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 0.3850 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -1.5700 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.0160 0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -1.8140 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.5790 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -0.7520 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -0.1580 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 0.0930 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 0.8020 -4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -0.8680 -4.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -2.5870 -6.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 1.8460 -5.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 2.3790 -6.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9980 1.3440 -6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 2.5560 -7.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 0.9050 -9.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8490 -0.0740 -8.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 -4.1800 -7.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 -5.9230 -9.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7740 -3.1920 -11.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -1.4440 -9.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7200 -4.9760 -11.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -4.4510 -12.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -6.1370 -12.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M CHG 1 13 1 M END