IBS-ZINC05041334 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.0480 1.5020 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -0.0040 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -0.7000 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -2.0800 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -2.7730 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.0650 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.6860 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2510 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -4.8630 1.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -4.9200 -1.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 -6.3810 -1.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7480 -6.8660 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -6.5910 -2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 -5.1890 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -4.3400 -2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -4.8460 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -5.8550 -5.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -5.5270 -7.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -4.2020 -7.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -3.1950 -6.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -3.5060 -5.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.5170 -4.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -6.8990 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5560 -6.1760 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 -6.6460 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -7.8460 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -8.5750 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -8.1000 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 -9.7520 1.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -10.4460 1.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7720 -8.3110 1.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9520 -7.5100 1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 1.8850 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 1.8610 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 1.8500 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.1620 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6220 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.5950 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -0.1370 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -7.1810 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -7.0710 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -6.8900 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 -6.3080 -7.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -3.9540 -8.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -2.1640 -6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -2.2800 -4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -5.2400 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6110 -6.0790 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -8.6650 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -11.3670 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -10.6850 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -9.8140 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7670 -7.9940 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 -6.5280 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 -7.3980 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 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 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END