IBS-ZINC05397460 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -5.9160 7.5700 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 7.0340 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 5.7500 -0.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 7.0970 -2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0900 5.6300 -1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6520 6.8670 -1.4520 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 7.7540 -0.5710 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 4.1250 -1.9180 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 2.9980 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 2.0430 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 1.8440 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 1.4380 0.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.2530 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 1.4700 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.8740 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 2.0550 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 1.2860 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9120 0.7610 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 0.0550 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 1.9040 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 3.0940 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8770 2.3160 -0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 7.5130 2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 8.6090 1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8280 6.9770 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 1.4270 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 1.2690 1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 0.9400 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 2.0410 -2.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 2.3640 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.0490 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 0.7670 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -0.3460 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -0.7600 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8530 2.6160 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.4070 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 1.5030 3.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6600 4.0450 -2.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6230 4.0680 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 38 39 1 0 0 0 0 M END