IBS-ZINC02098086 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -0.7390 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -0.0630 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6600 -0.7720 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 -2.1660 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4340 -2.8510 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -2.1460 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.7940 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -2.1270 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -2.7540 0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -0.7180 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 -0.0050 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 0.1340 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3390 0.8470 -1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 1.2080 -0.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 1.0820 -2.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2880 1.7750 -2.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8380 1.4900 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 1.3940 -3.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4450 1.1720 -3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1760 0.8220 -4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5460 0.6950 -5.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1860 0.9180 -6.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4560 1.2720 -4.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 3.2650 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 3.7020 -2.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8060 -2.8580 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 1.0170 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 -0.2510 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -3.9310 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -0.5780 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 0.9850 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 0.7070 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 -0.8560 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 0.7930 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9370 1.2720 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2380 0.6480 -4.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1170 0.4210 -6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6940 0.8180 -7.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 1.4500 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1530 -3.0630 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1050 4.1050 -2.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9080 5.0520 -2.4680 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 12 2 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 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 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 28 45 1 0 0 0 0 46 47 1 0 0 0 0 M END