CHEMDIV-ZINC02787163 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.0800 1.4220 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.0990 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -0.5820 0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -1.9240 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 -2.7550 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -4.1180 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -4.6650 0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9040 -3.8330 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -2.4530 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -4.6320 0.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -5.8810 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -5.9580 0.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -6.7650 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7410 -7.2560 0.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3210 -6.4030 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4420 -7.4100 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1960 -8.5890 0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7160 -7.0010 0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7480 -7.9440 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0060 -7.6540 0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0280 -8.5770 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8070 -9.8020 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5410 -10.1010 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5130 -9.1600 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2980 -11.4010 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1950 -12.2160 -1.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8120 -10.7080 -0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 1.7910 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 1.6860 -1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 1.8740 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.5510 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3620 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6470 -2.3310 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3440 -4.7580 0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -1.8040 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4670 -5.6870 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3150 -5.8760 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9200 -6.0530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1850 -6.7020 0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0030 -8.3450 0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5370 -9.3820 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3440 -10.6270 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0800 -11.6860 -1.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 -12.5500 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 27 42 1 0 0 0 0 43 44 1 0 0 0 0 M END