IBS-ZINC02098387 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5100 -0.3560 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 -0.4860 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -2.0120 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -2.5880 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -1.9370 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.5220 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9830 -0.4410 -1.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1240 -0.6350 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 -1.3770 -1.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8370 -1.5930 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 -2.7660 -1.1820 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4000 -3.4580 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.6700 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4990 -3.2040 -1.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 -2.2460 -1.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4140 -2.3850 -2.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -0.9210 -1.8390 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7450 -0.3730 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -0.0950 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7760 1.1780 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2120 1.6480 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6800 2.4840 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0220 2.9230 1.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5580 3.7160 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3930 0.9050 -1.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 0.3870 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9040 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8780 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 -0.0480 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.1870 2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.3020 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -2.3840 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -3.6010 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -3.6740 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6240 -2.1360 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8980 -0.7090 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 0.7630 -0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 2.0440 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7380 0.5720 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2500 2.2540 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8640 0.7820 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6430 1.8780 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0290 3.3500 1.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5780 4.0100 1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5590 3.1360 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9450 4.6080 2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 1.0340 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 1.4130 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 0.0560 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 0.3390 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 0.3750 -0.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4130 0.8940 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 54 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END