IBS-ZINC05025948 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -1.8880 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.2660 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -3.7890 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -4.1510 -3.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -5.4480 -4.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -6.3200 -3.4850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -5.8090 -5.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 -6.0360 -6.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -6.3680 -7.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -6.6270 -8.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 -6.5860 -9.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -6.8610 -10.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -6.8160 -11.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -6.5000 -10.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -6.2270 -9.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -6.2640 -8.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -5.9980 -7.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -6.3300 -6.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5170 -5.9980 -5.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -5.8720 -4.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 -6.6030 -7.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7910 -5.3000 -7.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1770 -5.5800 -8.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3650 -5.9030 -9.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6370 -6.1600 -10.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7220 -6.0940 -9.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5340 -5.7710 -8.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2620 -5.5090 -7.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -2.2880 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 -2.3040 -1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -1.8650 -3.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -1.8490 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -4.1890 -1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -4.2060 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -3.4560 -4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -7.1070 -11.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 -7.0290 -12.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -6.4700 -10.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 -5.9820 -8.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 -5.6350 -3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 -6.0210 -4.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7660 -7.0240 -6.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0990 -7.3120 -8.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 -4.8780 -8.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8480 -4.5900 -7.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 -5.9540 -10.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7840 -6.4130 -11.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7150 -6.2960 -9.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3810 -5.7190 -7.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1160 -5.2520 -6.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 M END