IBS-ZINC01816591 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -1.2280 0.4290 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 1.0080 3.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 2.8340 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 3.3340 0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 4.8170 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 5.3420 -1.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 5.7430 -1.0830 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6980 4.8320 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 6.1710 -2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1670 6.0340 -3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 5.4870 -2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 5.2280 -2.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 6.2930 -4.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 6.7240 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5020 7.7750 -3.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 6.0180 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0830 6.3750 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8960 5.3040 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2750 5.0370 -2.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7040 3.8130 -2.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7890 2.8720 -1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 3.1210 -1.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0190 4.3450 -2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 4.7760 -2.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 6.8150 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 6.7530 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 7.7500 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 8.7830 1.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8780 8.8830 1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 7.9120 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -0.5890 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1470 0.5590 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 0.6460 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 1.1420 3.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -0.0320 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 1.6590 3.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 2.9210 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 3.4060 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 2.7720 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 3.1800 0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 5.4070 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 4.9530 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 6.0730 -4.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4080 7.3020 -3.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9990 5.7570 -2.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7690 3.5920 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1540 1.9300 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6910 2.4010 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 5.9330 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 7.7230 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 9.5820 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 8.0450 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 1.3790 1.8350 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9270 1.2580 1.7060 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