IBS-ZINC05274301 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0760 -4.6440 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -4.7980 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -6.2920 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -6.9940 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -8.3860 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -8.9900 -1.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -8.2930 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -6.9740 -1.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -8.9630 -1.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2040 -10.4090 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5530 -11.1240 -1.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2900 -10.5960 -2.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5140 -9.1500 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -8.4360 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4920 -11.2720 -2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 -10.9180 -3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5300 -11.5990 -4.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8390 -12.6150 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9550 -12.9140 -2.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3410 -6.2760 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -6.8720 -0.4210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -4.7650 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -4.5260 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -4.3410 -1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -8.9530 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -10.6030 -2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -10.7780 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3880 -12.1930 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 -10.9520 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -8.7820 -3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1030 -8.9570 -1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -7.3670 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -8.6080 -3.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0650 -10.1210 -4.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2050 -11.3450 -4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7630 -13.1660 -3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1920 -13.7040 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -4.4660 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 -4.3450 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8210 -12.2520 -2.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 30 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 55 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END