IBS-ZINC02090629 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.2090 1.5650 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.0850 0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6710 -0.8030 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 -2.2740 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0650 -2.4840 0.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7510 -1.7760 -0.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -0.2520 0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9670 0.0300 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 0.3980 -1.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -0.6240 -2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -0.8790 -2.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -0.2050 -1.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 1.7680 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 2.2160 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 1.8580 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7570 -0.6690 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.5170 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -2.6390 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -2.8770 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -2.1330 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -2.0520 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 1.3610 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 0.1170 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 0.2210 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 0.5560 -1.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 0.2070 -1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -1.0770 -1.9800 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 27 1 0 0 0 0 12 24 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 27 -1 M END