IBS-ZINC02114503 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7860 1.8490 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 3.0850 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 3.1160 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5240 1.9870 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9570 0.8040 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 0.6790 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.4070 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.3330 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5200 4.4170 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8820 5.4520 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8670 4.4560 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5620 5.7460 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0740 5.5090 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8000 6.8560 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9830 7.8820 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4860 7.5910 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8730 6.9610 -1.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1810 5.7380 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6760 6.0100 -1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7690 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 4.0010 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 -0.0830 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 3.6300 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2740 6.3140 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2910 6.3050 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3620 4.9410 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3450 4.9500 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5120 7.4240 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5290 7.4150 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6720 8.3100 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7680 8.5880 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0350 8.5250 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7080 6.9280 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5100 5.3320 -2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3950 5.0210 -0.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4560 6.6850 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1400 5.0720 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2520 6.6290 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 M END