IBS-ZINC02311947 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -2.0210 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 -2.4820 -2.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.6580 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 -0.3760 2.3950 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -0.6320 3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -1.1070 2.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -1.1120 1.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -1.5280 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -1.4570 3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7340 -1.8760 2.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 -1.3240 4.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -0.8630 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -0.7570 6.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -0.5170 4.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -0.0190 5.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 -1.6860 5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7470 -3.1390 6.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1110 -3.5020 7.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0280 -4.8340 7.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5810 -5.8050 6.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -5.4420 5.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3050 -4.1080 5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -7.4790 7.1720 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.2120 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -0.0490 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 -2.3060 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -2.4690 -1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -3.4410 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -2.5940 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -1.3320 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9790 -0.9680 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 1.0650 5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -0.4660 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -0.2870 4.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8620 -1.0700 6.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 -1.5210 5.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -2.7440 7.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -5.1180 8.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6490 -6.1990 4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8050 -3.8240 4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 M END