IBS-ZINC04870836 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -2.0830 1.7770 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 0.6770 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 0.1960 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -0.3810 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -1.7090 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -2.4500 0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -3.8650 1.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7190 -4.4080 2.3050 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2640 -3.8860 3.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -5.8670 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -6.1240 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -4.8120 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -4.6540 -0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 -7.1800 0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5020 -6.7380 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -6.3180 4.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -8.1540 3.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -8.6040 4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -9.9590 4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -10.8610 3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -10.4340 2.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -9.0790 2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 -12.1630 3.4030 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 -4.2070 2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -3.6910 3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2520 -3.5020 3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0100 -3.8290 2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3880 -4.3500 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -4.5420 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 2.4650 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 2.3630 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 1.3630 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2040 1.0650 2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 0.1370 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -0.0720 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 1.2870 0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -1.4700 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -0.1150 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 0.0210 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -1.5980 2.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.2640 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -1.9970 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -2.3940 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -7.1030 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 -7.9040 4.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -10.3150 4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -11.1550 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -8.7510 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3000 -3.4440 4.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7410 -3.1080 4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0870 -3.6840 2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9820 -4.6120 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -4.9550 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -0.3130 0.6010 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.3880 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 54 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 54 1 0 0 0 0 4 37 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 40 1 0 0 0 0 5 41 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 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 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END