IBS-ZINC04994114 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -2.8220 9.2040 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 8.2400 4.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 6.9370 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 6.9790 1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 5.5790 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 5.6300 -0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 5.8490 -0.6140 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.0420 6.8160 -0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 5.8280 -2.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2280 5.5870 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 5.4880 -1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 5.3000 -1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 5.4970 -3.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 4.7100 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 3.5900 -2.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9450 4.9760 -3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4720 6.2660 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7820 6.5110 -3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5790 5.4850 -3.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0660 4.2010 -3.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 3.9420 -3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8550 3.1970 -4.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2000 3.5360 -4.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 4.7500 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 3.4970 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 2.4880 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2010 2.7300 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7320 3.9810 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9180 4.9970 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4360 6.2300 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8280 6.4120 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 10.2080 3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5760 8.8750 4.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 9.2160 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 7.8380 5.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 9.2480 5.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 7.6040 4.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 6.5970 3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 6.2500 3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 7.6670 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6170 7.3190 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 4.9000 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 5.2220 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0170 6.7860 -2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8520 7.0700 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1870 7.5080 -3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6040 5.6840 -4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 2.9450 -3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7130 3.9260 -3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1960 4.2940 -5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7190 2.6470 -5.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 3.3050 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4470 1.5090 0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8330 1.9400 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7790 4.1690 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1120 7.4380 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4100 5.7250 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0220 6.2110 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 8.2810 3.5960 N 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 59 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 59 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 3 59 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 11 12 2 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 2 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END