IBS-ZINC01088353 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -0.5510 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -1.9460 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -2.6800 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -2.0280 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -2.7520 -0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 -3.1090 1.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -4.0390 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8280 -4.6420 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 0.2350 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 1.5160 -0.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 1.8730 -0.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 0.8450 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -0.2380 0.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4750 -1.5510 0.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -1.9220 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 -3.3040 2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8530 -3.6990 3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2080 -4.9980 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5500 -5.8620 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5270 -5.4050 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1920 -4.1620 1.3220 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 0.8550 0.4970 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -2.4520 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -2.2050 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -3.7120 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -3.6820 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -4.3340 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 -4.3240 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -5.7260 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 -1.2200 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -3.0000 4.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2170 -5.3320 4.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8300 -6.8830 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7930 -6.0760 0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1400 0.5590 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 26 43 1 0 0 0 0 M END