IBS-ZINC02130947 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.4880 -0.1220 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -1.3450 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -1.4010 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -0.2330 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 0.9900 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 1.0440 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -0.3150 -0.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8240 -1.3330 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 0.6510 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 1.7260 -1.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 0.0040 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 0.9470 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -0.8610 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3920 -2.0200 1.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9790 -0.2180 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7650 -1.1490 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0280 -0.4670 2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8170 -1.3880 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0830 -0.7000 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8330 -1.5750 5.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8010 -2.4140 4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0650 -2.4620 3.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5380 -3.2880 5.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5250 -4.1600 5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2080 -4.9760 6.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9040 -4.9200 7.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9170 -4.0470 7.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2360 -3.2320 6.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2500 -2.3600 7.3780 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0250 -2.3160 8.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5300 -1.5250 6.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6760 -0.7900 7.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -0.0800 2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3550 -2.2570 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 -2.3630 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 1.9090 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 1.9980 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6050 0.0850 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 0.6880 1.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1310 -1.4600 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0390 -2.0620 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6620 -0.1650 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7510 0.4480 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1850 -1.6900 4.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0890 -2.3080 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7220 -0.4110 3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8130 0.2210 4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7670 -4.2080 4.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9770 -5.6570 5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4370 -5.5570 8.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6910 -4.0150 8.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 0.2480 -2.6730 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 9 52 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 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 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 M CHG 1 52 -1 M END