IBS-ZINC02104508 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 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 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5260 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -2.7710 3.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -3.3320 4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -3.5990 5.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 -3.5580 4.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5510 -4.1940 5.7710 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9270 -4.1490 6.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 -3.4240 6.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -2.5080 5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 -2.0010 5.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 -1.0500 5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -0.8130 6.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7330 -1.4780 7.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8320 -2.4240 7.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -2.6840 6.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6670 -3.5350 7.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 -4.1280 7.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -2.1190 3.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 -3.2040 3.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1810 -4.0880 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -2.7220 2.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3220 -2.4910 1.2670 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -5.6510 5.4340 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 1.7650 -0.1340 1.2340 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 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -1.8330 3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -3.4760 3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 -0.5260 4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2930 -0.0850 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 -1.2520 7.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9810 -2.9350 8.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -1.1650 3.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4120 -2.0330 3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 -5.6880 4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 -6.1140 6.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 -6.1900 5.2350 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 27 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 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 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 M END