IBS-ZINC05425468 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 49 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6920 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0790 1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7380 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.9560 -0.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0090 -1.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6650 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0340 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6880 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8560 2.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -2.8980 3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -3.7120 4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -4.2000 4.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 -3.6660 2.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -5.1540 4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -4.8950 6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3700 -4.7320 6.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -4.1280 5.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.9420 5.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0960 -4.3780 7.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -4.9980 8.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -5.1720 7.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -5.3390 9.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 -5.2840 8.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3750 -4.3230 7.5570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -0.0160 2.3840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.8700 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0620 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.6380 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -2.3740 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -3.8480 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -6.1680 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -5.0450 4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -5.7320 6.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -3.9880 6.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1600 -3.4600 5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -5.6530 8.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7400 -6.2580 8.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0970 -4.9430 9.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 0.9530 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.5090 3.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END