IBS-ZINC06624591 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1960 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.8480 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.7360 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.3710 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -1.2890 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 3.2690 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 3.7850 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 5.1660 1.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 6.2500 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 6.2660 1.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 7.4460 1.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7490 8.0690 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3000 6.8400 1.4880 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 5.5070 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 4.7030 1.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 8.2630 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7000 9.5270 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5850 10.3310 -1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 9.9330 -1.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 11.4930 -1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 12.0920 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 13.6060 -0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 13.5920 -2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 12.3710 -2.3690 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2190 12.6990 -2.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7990 11.6240 -3.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1780 11.3240 -3.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.7170 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 3.3030 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 3.8950 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 3.7510 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 3.1590 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 7.3100 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 7.6650 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 8.5420 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 10.1240 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 9.2480 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7270 11.9220 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1400 11.6800 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2590 14.0990 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 14.0790 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6810 14.5080 -2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1300 13.4500 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 10.6980 -3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 12.2490 -4.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6000 10.8500 -4.0890 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 M END