IBS-ZINC00545713 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.6320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 0.0160 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -2.1040 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -2.8650 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -4.2220 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -4.8400 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -6.0560 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 -4.0980 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -2.7530 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -4.7640 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -5.0010 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -4.0430 2.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -4.2550 3.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0610 -5.4310 4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 -6.3960 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -6.1790 2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -7.4500 4.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0810 -7.2980 5.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 -5.8790 5.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -2.3740 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -4.8220 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -2.1780 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -4.1340 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -5.7190 -0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -3.1250 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -3.5050 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3420 -6.9280 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9950 -7.8370 5.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -7.6420 6.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 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 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 M END