IBS-ZINC02246672 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 0 0 0 0 0 0 0 0999 V2000 0.2100 1.0680 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -0.2700 -0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.7190 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 0.0650 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6290 -0.4860 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -1.8020 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -2.6120 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -2.0520 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -2.7360 0.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -4.0810 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -2.0900 0.6550 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 -2.9970 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8240 -0.9940 0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9630 0.0070 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3900 1.2240 -0.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7190 1.3500 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6220 0.4370 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2050 -0.7760 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1480 -1.6740 0.9160 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4920 -1.6110 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0040 -3.0190 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4390 -3.9990 1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9450 -2.5870 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4540 -5.3180 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6860 -6.1580 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7390 -5.8600 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9480 -6.6340 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1080 -7.7100 4.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0630 -8.0200 3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8520 -7.2490 2.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 1.2540 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 1.2130 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 1.7830 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 1.0920 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -3.6330 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -4.7110 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -4.4620 0.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -4.1420 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1190 2.3030 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1690 -1.1320 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5250 -1.0200 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0610 -2.9840 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4200 -3.4690 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8390 -4.4500 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4120 -4.6340 2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9060 -2.6380 2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -2.2080 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7760 -5.8070 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4130 -5.1640 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4200 -5.0350 2.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7700 -6.4030 4.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2730 -8.3130 5.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4160 -8.8670 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0330 -7.5170 1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8810 -3.9480 1.1970 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.4490 -3.5460 1.9540 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 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 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 55 1 0 0 0 0 23 46 1 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 24 49 1 0 0 0 0 24 55 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 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END