IBS-ZINC05307256 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 0.3240 0.9140 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7840 -0.1210 0.9210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.7560 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -1.6090 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -2.3110 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -2.1740 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -1.3280 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1670 -0.6170 -1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 -2.8890 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 -2.2970 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -1.1030 0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1220 -3.3490 0.1250 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8430 -3.1900 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -3.4200 1.5110 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8370 -3.7130 1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6010 -2.0710 2.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2780 -2.2020 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 -3.6180 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5910 -5.4490 1.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.4150 -6.1510 1.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3320 -4.6750 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6270 -5.2390 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -4.2220 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -4.9520 -0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3460 -6.1820 1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6720 -5.7500 2.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -7.4210 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -8.1030 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4260 -9.2640 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1980 -9.7530 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3420 -9.0830 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 -7.9250 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 1.3820 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 0.3390 -2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 1.6850 -1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -1.7160 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9790 -2.9700 1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 -1.2250 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 0.0430 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5310 -1.2620 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4270 -1.8910 2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5640 -1.4500 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4570 -2.1020 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0450 -3.5790 1.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2940 -4.0620 3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 -7.7220 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -9.7920 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -10.6620 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -9.4710 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6220 -7.4060 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -4.3990 2.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 52 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 20 52 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 31 32 2 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 32 50 1 0 0 0 0 33 51 1 0 0 0 0 M END