IBS-ZINC04024633 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.1810 -0.7290 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 0.0020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 1.4160 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.1260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 1.8520 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 0.7370 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -0.3710 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -1.2860 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 0.7180 -0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4310 0.6040 0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5150 -0.3310 -1.0800 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5830 -0.5260 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 -1.6400 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 -2.3740 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -1.7590 -3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 -0.2610 -3.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 0.4090 -2.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2530 0.3200 -2.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 1.8320 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 2.7000 -2.8600 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 1.9940 -0.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 3.2050 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3800 3.5260 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 3.2990 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 1.8920 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -0.5360 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -1.8080 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 3.2060 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 -2.2240 -0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -1.4580 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 -3.4470 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 -2.3720 -4.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2400 0.0220 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9280 0.0550 -4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4860 3.0590 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8710 4.0350 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 2.8730 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4040 4.5660 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 3.5880 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 3.9230 0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 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 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END