CHEMBRIDGE-ZINC01208592 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.9570 1.4350 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 0.0850 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -0.3590 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -1.5990 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -2.4310 0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -1.9860 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.7410 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.2650 -2.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.9270 -3.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.0920 -3.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.0940 -4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.2160 -4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 1.9820 -6.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 1.4380 -7.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 0.1180 -7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -0.6500 -6.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7580 -0.4770 -8.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -1.1430 -8.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.2190 -9.5620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3890 -0.5500 -10.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -1.1440 -11.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9470 -1.4470 -12.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -1.1450 -13.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -0.5540 -13.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.2500 -11.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 0.3880 -11.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 -2.0800 -12.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -2.2900 -11.9810 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3790 -3.7720 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 -4.4640 -0.0470 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8160 1.3380 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 2.1040 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 1.9110 0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 0.2590 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -1.9210 2.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 -2.6430 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 0.6680 -2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 1.6450 -3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 3.0030 -6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 2.0600 -8.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -1.6730 -6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 0.2550 -9.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 -1.3790 -10.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -1.3710 -14.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.3340 -14.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 1.3790 -11.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 0.5190 -12.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -0.2410 -10.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 -2.3550 -14.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -4.1090 2.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 2 0 0 0 0 29 30 1 0 0 0 0 29 50 2 0 0 0 0 M CHG 1 28 -1 M CHG 1 30 -1 M END