IBS-ZINC02277413 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 0.8210 -5.5790 5.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -5.0560 4.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 -3.9140 3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -3.2710 4.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -2.1050 4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -1.5730 2.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -2.2100 2.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -3.3680 2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.0270 1.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 -3.5280 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -1.7890 0.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3820 -0.6690 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -1.4530 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7040 -2.1240 5.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -0.1250 5.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 0.6100 6.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 1.9370 6.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 2.8280 7.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 3.8940 6.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 4.7630 7.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5500 4.5650 9.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 3.5230 9.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 2.6580 8.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 5.3960 10.0750 F 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -0.0900 7.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 0.1980 7.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -1.0230 7.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 -1.8480 8.9390 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7500 -2.1300 8.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -1.0530 10.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -0.5050 10.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7440 0.2600 11.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5200 0.4950 12.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -0.0290 12.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 -0.7940 10.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8750 -3.1620 9.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7830 -3.1430 8.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -4.8570 6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -6.4620 5.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 -5.8990 5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -3.6430 5.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -0.6860 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 -3.6960 3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -2.4650 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -4.0780 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 0.2340 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -0.8660 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.4970 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 0.3560 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 2.4500 5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 4.0430 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 5.5850 7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 3.3830 10.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5490 1.8460 8.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -1.2320 7.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 -0.6650 10.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6570 0.6740 12.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 1.0870 13.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.1540 12.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -1.1890 10.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3730 -4.0860 9.7490 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 48 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 49 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 50 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 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 36 37 2 0 0 0 0 36 61 1 0 0 0 0 M CHG 1 61 -1 M END