IBS-ZINC01816592 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.3890 1.1700 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 1.3230 2.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 3.1750 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 3.4660 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 4.9510 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 5.2950 -1.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 5.5570 -1.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4330 6.4230 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 5.9320 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 5.8750 -3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 5.4580 -2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 5.3090 -2.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 6.1530 -4.5690 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 6.2580 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 5.7230 -4.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 7.1630 -2.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 7.4910 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3500 8.4450 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5140 9.1610 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4720 10.0520 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 10.2300 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1350 9.5240 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2090 8.6470 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 7.8730 -1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1140 4.3870 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0220 4.5280 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 3.4390 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 2.2310 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 2.0490 -0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0330 3.1300 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 0.1000 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.7090 0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.3220 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.8400 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 0.2380 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 1.6300 3.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 3.6910 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 3.4780 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 3.1830 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 2.8590 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6820 5.2530 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 5.5450 0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 6.0280 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6110 7.0870 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4300 9.0340 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3650 10.6150 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3010 10.9320 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2210 9.6540 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 5.4840 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4970 3.5310 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 1.3530 0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 2.9400 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.6870 1.5060 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4670 1.1960 1.3580 H 0 0 0 0 0 0 0 0 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 1 53 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 53 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 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 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 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 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END