IBS-ZINC04086945 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 50 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5240 -1.7810 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -0.3350 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 -0.6490 0.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6900 0.0050 -0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9500 1.0270 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9200 -0.8190 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 -0.7980 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9530 -1.7180 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9820 -2.6160 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9810 -2.6540 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -1.7390 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -1.5410 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -2.1000 2.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 -0.0050 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -0.3310 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -0.2290 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 -0.4180 -3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -0.2360 -4.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 0.1180 -5.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 0.3120 -4.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 0.1360 -3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 0.2690 -2.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0290 0.4940 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 0.7300 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 -0.9140 2.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9030 -0.0990 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7540 -1.7320 -1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8080 -3.3070 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0080 -3.3580 1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 -0.6950 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -0.3740 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 0.2460 -6.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 0.5880 -5.4580 H 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 M END