IBS-ZINC02139752 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 -0.7080 1.2330 0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0240 0.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4970 -0.1070 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7670 0.1790 2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -1.1500 3.4510 P 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -1.9290 3.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.1540 4.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -0.9660 5.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -0.0540 6.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 0.9330 7.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.8310 2.8330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0940 -0.0990 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3910 0.9500 -1.8420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 2.1340 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 1.3370 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 1.2210 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -1.0940 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 0.6190 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8450 0.3180 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 1.1240 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 0.3740 5.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.6090 4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -1.6370 5.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.5970 6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8270 -0.4070 7.2980 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1990 -1.2680 -1.6360 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7430 -1.2150 0.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5970 -1.9410 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -1.0720 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -1.6060 1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 2 0 0 0 0 9 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 M CHG 1 11 -1 M CHG 1 25 -1 M CHG 1 26 -1 M CHG 1 27 1 M END