IBS-ZINC05269604 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5030 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6930 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.0090 -0.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.7150 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -4.0920 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -4.2550 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -3.0720 0.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -2.0880 0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -0.7190 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 -0.0670 0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 0.7640 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 0.3310 -1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6090 -0.5840 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -0.1900 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5520 0.1310 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 0.4210 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9020 1.5980 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -0.6420 2.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -5.1740 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -6.2170 0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -7.2220 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -7.1970 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 -6.1660 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -5.1580 -1.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.0740 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 1.8620 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.8560 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -5.2000 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 1.8130 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 0.6260 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 1.0080 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -0.6840 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -1.5840 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -0.5720 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -0.9590 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 0.7650 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6970 -0.9100 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 0.7820 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4740 1.8060 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7850 2.3600 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 -0.5650 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4680 -0.5040 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4910 -1.6260 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -6.2380 1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -8.0300 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 -7.9860 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -6.1510 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -4.3550 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 0.2570 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -0.5070 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.0260 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 0.3730 0.1050 N 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 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 54 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 54 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 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 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 M END