IBS-ZINC05093580 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.0800 1.4000 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -0.1090 -0.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8290 -0.5310 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -0.3700 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 0.2960 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1340 -0.3430 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 -0.2600 -1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9380 0.2400 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 0.5680 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 -0.2690 -1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6320 0.0430 -1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 1.1840 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1820 2.0180 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 1.7140 -2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7720 1.5700 -2.3200 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -0.7630 -1.2650 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2940 -0.3870 -2.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -0.8400 -2.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -0.0870 -2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 -0.8620 -2.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.1090 -2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -2.1470 -2.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -2.1830 -1.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 1.8220 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 1.5860 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 1.8650 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 0.0380 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 -1.4450 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 1.3610 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 0.1610 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 0.1950 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 -1.3870 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 0.4070 -3.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 -1.1580 -1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3360 -0.6040 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 2.9060 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 2.3630 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 0.6950 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.8640 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1970 0.9720 -3.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -2.9530 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -2.6610 -1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 23 42 1 0 0 0 0 M END