CHEMDIV-ZINC06748280 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -1.6950 -1.5400 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -2.4810 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -3.2980 -2.2290 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -3.4410 -3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 -3.9080 -2.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -4.6420 -2.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3930 -3.6810 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8320 -2.8420 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -2.2690 -0.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 -2.6060 1.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 -3.4320 1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 -3.1970 2.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 -4.6450 0.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 -4.3380 -0.5750 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7860 -5.2660 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8320 -3.4120 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9540 -2.1660 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9720 -1.3140 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8710 -1.7040 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7520 -2.9530 -2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7250 -3.8050 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6350 -3.3400 -3.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -1.4720 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -0.0820 0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2510 -1.8360 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 -5.4740 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8830 -4.9180 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2520 -1.8590 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0650 -0.3420 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6670 -1.0380 -2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -4.7760 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3680 -3.1060 -4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 31 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 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END