IBS-ZINC02217436 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.7570 -0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -2.1870 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -3.5340 -1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -3.9460 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 -3.5780 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6580 -3.9200 -2.1730 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1620 -4.6610 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4990 -5.1930 -0.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7300 -5.1230 -1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8240 -5.7390 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7190 -6.4360 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5140 -6.5180 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3860 -5.8980 0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0790 -5.8120 0.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7340 -6.2140 1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 -5.0720 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9700 -4.6950 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2020 -5.0330 0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 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 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1990 -1.6620 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -2.5050 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 -2.2820 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -1.4390 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8370 -3.4400 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -4.2830 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0320 -2.9820 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8200 -4.5820 -2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7760 -5.6840 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5920 -6.9170 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4430 -7.0620 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M END