IBS-ZINC00542524 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8250 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6690 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -4.0530 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -4.5770 1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -3.7300 2.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -2.3550 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -1.5240 3.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -4.9600 -0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 -6.3200 -0.4580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -6.8640 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -6.7770 -1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -5.6480 -2.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8630 -4.5790 -1.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -5.8160 -3.4630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 -7.0540 -3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 -7.1820 -4.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -8.1520 -3.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -8.0540 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -9.0570 -1.5220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -9.4770 -3.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -4.6450 -4.2120 C 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 -1.0200 -0.3810 0.0100 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 -0.2570 -2.2600 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -5.6470 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0900 -4.1370 3.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -1.2950 4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -9.7910 -4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -10.1930 -3.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 -9.4320 -4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -4.3400 -4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3220 -4.8970 -4.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6120 -3.8280 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 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 30 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 M END