IBS-ZINC04817730 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 0.9040 1.7330 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 0.5610 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 0.0860 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.4240 1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.8290 -1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -2.5170 -2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -3.9440 -2.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -4.5170 -3.4230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5250 -4.0500 -3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -5.9870 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -6.2110 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -4.8780 -1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0920 -4.6970 -1.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -7.2640 -1.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -6.9030 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -6.5020 -4.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -8.2970 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -9.3180 -3.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -10.7190 -3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -11.5580 -3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 -12.9030 -3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -13.4250 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -12.6070 -2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -11.2610 -2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -4.2570 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -3.6850 -5.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -3.4230 -7.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -3.7390 -7.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -4.3060 -6.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -4.5690 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -3.4260 -9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 2.3250 -1.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 1.3900 -2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 2.3980 -3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 0.8780 -1.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 0.0170 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -0.2540 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 1.1800 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -0.0410 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -1.5160 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -0.0870 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.7910 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -2.3760 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -2.0540 -3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -2.4130 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -7.2130 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -8.5080 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -9.1550 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -11.1680 -4.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 -13.5430 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -14.4720 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -13.0130 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -10.6470 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -3.4450 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -2.9760 -7.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -4.5520 -7.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -5.0170 -4.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -2.4170 -9.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -4.1410 -9.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -3.4870 -9.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -0.3960 -1.1740 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6150 -0.3980 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 61 1 0 0 0 0 4 39 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 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 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 25 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 46 1 0 0 0 0 17 18 2 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END