IBS-ZINC04029985 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.0640 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0220 1.0250 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.5840 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1080 -0.0740 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.4990 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.6220 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -1.3080 3.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -1.6000 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -0.0990 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -1.6740 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -0.2230 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1190 -0.4750 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 1.0160 1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.3570 4.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -0.7370 5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 21 22 1 0 0 0 0 M END