CHEMDIV-ZINC06720945 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -2.6110 -2.7540 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -4.3520 -2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -5.2300 -3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9130 -6.6280 -3.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -7.3220 -3.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -7.2400 -2.4950 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -6.5310 -1.7680 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3680 -7.1620 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -4.9940 -1.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -6.2090 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -6.8390 -3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -6.5440 -4.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -5.6190 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -4.9870 -3.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 -5.2850 -2.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -4.6680 -1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -4.6940 -4.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2110 -4.2680 -5.5070 N 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 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -8.2000 -2.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -7.5620 -4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -7.0370 -5.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -5.3900 -5.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8860 -4.2640 -2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -3.8430 -1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 21 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 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 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 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 37 1 0 0 0 0 21 22 3 0 0 0 0 M END