IBS-ZINC04981535 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 1.5590 -0.9150 1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -1.2460 0.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -0.2030 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -0.2660 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 0.2500 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 1.6810 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 2.0360 3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8870 3.4060 3.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2440 3.7620 2.9280 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4140 3.4440 1.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3520 5.2920 3.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9880 5.7310 3.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 4.4910 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 4.4670 4.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 6.8630 3.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 5.6790 4.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1340 5.8490 5.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8120 5.8520 3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1450 5.6560 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4500 5.8180 1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4310 6.1740 2.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1110 6.3700 4.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8060 6.2050 4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0800 6.7190 4.9420 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4060 6.8660 4.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2500 3.1110 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 2.6140 3.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3370 2.0230 4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0160 1.9490 5.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8740 2.4320 6.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9950 2.9950 5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -1.8060 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1440 -0.1280 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -0.5740 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -1.5740 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -2.0420 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 0.6480 -0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -1.1220 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 0.6530 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -1.1170 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.3790 -2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 0.1500 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -0.4460 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 2.3700 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 1.7590 1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 1.3470 3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 1.9580 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 5.7250 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3820 5.3800 1.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7060 5.6680 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4510 6.2990 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 6.3530 5.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0800 7.1450 5.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4150 7.6420 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7340 5.9220 3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6660 2.6870 2.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2750 1.6270 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7090 1.4900 6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 3.3750 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -0.0500 0.8390 N 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 60 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 60 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 60 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 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 2 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 M END