IFLAB-ZINC04851694 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 1.0150 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 3.0270 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 3.4810 2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 4.9440 2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 5.6190 1.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 6.9700 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 7.6430 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 6.9440 3.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 5.6140 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 4.9930 3.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 9.4030 2.6370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 9.6660 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 11.1430 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 11.9400 3.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 11.5790 4.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 12.9420 5.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 13.4650 5.8180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 14.7820 5.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 15.4010 5.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 14.1720 4.3250 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 7.5060 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 6.2970 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7280 5.1080 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.3320 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -0.0740 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 1.3810 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 3.4080 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 3.4130 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 3.0950 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 3.1000 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 9.1760 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 9.2450 3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 10.9420 5.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 15.3150 6.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 16.4690 5.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 8.2970 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 7.8770 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 6.2560 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 6.3260 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 4.8200 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 4.2630 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 46 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 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 37 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 M END