CHEMBRIDGE-ZINC04197012 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.3690 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.0080 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -0.6850 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 0.0260 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4030 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 2.0860 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 3.5620 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 4.1550 0.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 4.2520 -0.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 5.7170 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 6.2470 -0.3620 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3880 5.8130 0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 7.7880 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7360 8.2190 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2100 6.8870 -1.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 5.9530 -1.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7620 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -2.1670 -1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -4.2660 -0.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9960 -4.6820 -0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -4.6860 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -6.2120 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -6.7340 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -6.3140 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -4.7880 -1.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0070 -4.3710 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -4.3740 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -3.7280 -2.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 1.8940 0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -0.5630 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -0.5030 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 1.9540 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 3.7790 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 6.0790 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 6.0670 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 8.1970 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 8.1060 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 8.8410 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5740 8.7500 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 7.0010 -3.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 6.5510 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -2.5570 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -4.3140 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -4.2690 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -6.6290 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -6.5120 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -7.8220 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -6.3180 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -6.7310 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -6.6860 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -4.7240 -3.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -4.4350 -4.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 52 53 1 0 0 0 0 M END