CHEMDIV-ZINC01088681 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.1680 -2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -0.4340 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8300 -3.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.6080 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -1.9900 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -3.9620 -2.2660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -4.6900 -1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 -2.4780 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -3.6920 -4.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -1.7270 -5.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -2.3730 -6.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 -1.3020 -7.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -1.9660 -8.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 -2.2820 -9.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7650 -2.8910 -10.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 -3.1840 -10.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -2.8680 -9.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -2.2550 -8.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8980 -3.9610 -12.1510 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0520 -4.6140 -11.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -4.6390 -12.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 -2.7580 -13.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.2450 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2150 0.1700 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -2.5860 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 -4.4410 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -5.7590 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -4.4240 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9980 -0.7600 -5.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 -2.9860 -6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9670 -3.0020 -7.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3880 -0.6890 -7.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9380 -0.6730 -6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -2.0530 -9.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -3.1380 -11.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9060 -3.0970 -9.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8130 -2.0040 -7.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 -1.8280 -12.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9110 -2.9820 -13.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 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 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 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 44 1 0 0 0 0 25 45 1 0 0 0 0 M END