IBS-ZINC02271538 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 0 0 0 0 0 0999 V2000 1.2340 4.4640 4.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6140 3.0980 3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 2.5130 2.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 1.1680 2.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -0.0700 2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -1.0560 1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -2.4090 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -3.2960 1.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5730 -2.6940 3.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -3.6150 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -1.6910 4.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -0.4320 3.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -2.0350 5.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -3.3680 6.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -3.6830 7.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -2.6830 8.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.3620 7.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -1.0260 6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 0.2730 6.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2970 1.2460 7.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 2.6420 6.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -5.3650 7.8540 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -5.4000 9.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2520 -6.1390 6.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -5.7700 8.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -5.1500 9.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -5.6040 10.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -5.5710 9.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -3.6270 9.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -0.4140 0.7520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 0.9580 0.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -1.0510 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0860 4.8810 4.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 5.1350 3.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 4.3480 4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 3.2140 2.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 2.4270 4.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 2.3970 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 3.1840 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -4.1500 5.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -2.9390 9.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -0.5880 8.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 1.0440 7.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 1.1960 7.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 2.8440 6.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 2.6930 5.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 3.3850 7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -6.4170 7.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -6.6930 10.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -5.2430 11.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -5.1990 10.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -5.2480 8.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -5.1100 10.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -6.6560 9.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -3.3060 9.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 -3.1660 10.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -3.3260 8.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -1.3010 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -0.3650 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -1.9600 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 31 2 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 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 40 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 M END