IBS-ZINC05051991 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.1640 0.7870 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 0.8680 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 2.7280 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 3.0870 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0730 4.5400 0.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 5.4750 -0.4000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8080 5.2390 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 6.8560 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 6.6840 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 5.2300 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 4.7400 0.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 7.5690 0.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 8.0470 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 9.2180 -0.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 8.0400 -1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 7.1970 -2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 7.1940 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 8.0240 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 8.8650 -1.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 8.8810 -0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4960 9.6780 -1.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 9.6140 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 5.4010 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 5.2560 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 5.1870 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4430 5.2640 2.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 5.4100 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 5.4840 1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 5.1780 3.0280 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -0.3010 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 1.2040 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.0990 -0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 1.3430 3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -0.2150 3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6640 1.1780 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 3.2080 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 3.0730 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 2.7420 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 2.6070 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 9.9960 -0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 6.5480 -2.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8930 6.5430 -3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 8.0170 -3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 9.5380 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1420 8.6010 -1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 9.8810 -2.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4480 10.3100 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 5.1950 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 5.0740 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 5.4700 3.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 5.6010 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 1.2710 1.6650 N 0 0 0 0 0 0 0 0 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 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 M END