IFLAB-ZINC05298714 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0460 1.5020 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.7020 -0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.0830 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -2.0670 0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.6860 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.8390 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -4.2300 -2.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -6.3430 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -6.8470 -2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -8.3780 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -8.8080 -1.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -8.3070 -0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -6.7770 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -9.8360 -2.3100 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -9.6240 -1.4940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -9.6930 -3.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -11.4780 -1.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -12.1640 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -13.4410 -0.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -13.7910 -1.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -12.4660 -3.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -15.3230 -2.1650 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 1.8470 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 1.8810 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 1.8690 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -0.1670 -1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 -2.6280 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5990 1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -0.1380 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -4.6580 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -6.7620 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 -6.4490 -3.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -6.5180 -3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -8.7380 -3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -8.7800 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -8.6210 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -8.7030 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -6.3980 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -6.3800 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -11.7550 -0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -14.1030 0.0100 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 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 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 17 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 M END