IBS-ZINC04860298 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 0.0430 0.8450 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 0.8230 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 2.9150 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 3.4760 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 4.9980 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 5.5000 -0.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9560 6.8280 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 7.8950 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 9.2620 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 9.6610 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 8.6540 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8050 7.2560 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4050 6.5110 -3.1420 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 7.3980 -3.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 8.7040 -3.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 11.0430 -1.8070 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1080 11.8740 -1.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 11.3120 -2.1290 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.2460 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 1.2040 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 1.1760 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 1.1590 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -0.2670 2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 1.1720 3.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 3.2690 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2620 3.1980 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 3.2220 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 3.0290 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 5.2630 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 5.4450 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 4.8490 -1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 7.6740 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 10.0040 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 1.4020 1.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7650 1.0710 0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 34 1 0 0 0 0 2 22 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 34 1 M END