CHEMBRIDGE-ZINC04754948 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -2.4380 -1.9550 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -1.5540 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -2.1300 0.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -1.8720 1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -1.1880 0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -2.4360 2.3840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2670 -1.9930 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 -3.9530 2.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4160 -4.1730 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -4.5440 1.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2870 -4.2300 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3680 -4.0720 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -5.0970 0.7200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -6.2880 0.8530 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -6.0480 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -6.8480 1.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -2.6150 0.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -2.0870 2.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9110 -2.7210 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -0.6680 2.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 -4.5440 3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 -5.3110 3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 -5.8530 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -5.6290 5.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -4.8620 5.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -4.3160 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -4.6210 7.3020 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8940 -5.1000 8.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -3.9450 7.5460 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9400 -1.5860 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9070 -1.5230 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -3.0410 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -1.9230 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 -0.4680 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7520 -7.1730 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 -2.5150 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -2.0640 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2840 -3.7030 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 -2.0840 3.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -2.8270 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2420 -0.3710 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -5.4870 2.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -6.4530 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 -6.0530 6.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -3.7130 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END