IBS-ZINC06645433 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3590 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 -0.5890 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -0.3980 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 0.7860 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 1.8200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 0.6750 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -0.5390 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2610 -1.6230 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -1.5680 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 1.8050 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 2.6720 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 3.9740 1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 3.6510 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 2.7090 -0.1990 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2950 3.2070 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6980 1.4440 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0060 2.3400 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3370 1.1830 -0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 1.9660 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -2.5900 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 2.8970 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 2.1620 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 4.4910 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 4.6100 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8250 4.5730 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 3.1690 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 0.9390 0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8900 0.7770 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 3.2980 -0.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 3.0120 -0.3100 H 0 0 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 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 30 31 1 0 0 0 0 M END