ASINEX-ZINC04912594 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -1.1860 1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -0.1910 2.4530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -0.6760 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.1820 4.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -0.6890 6.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.2170 7.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -0.8630 8.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.0820 9.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2420 1.0120 9.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 0.9350 8.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -0.2110 -1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 0.5520 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 0.7180 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 0.1530 -2.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.6260 -3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -0.7880 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -1.5550 -3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 -2.1440 -4.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0640 -1.9900 -5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -1.2490 -4.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.4510 -2.4100 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 -0.6990 -3.0930 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -2.7400 -1.8520 O 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 -0.5170 0.3560 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -1.7660 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -0.2990 3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 0.9070 4.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 -0.5600 4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 -1.7790 6.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -0.3120 6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -1.8160 7.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -0.2980 9.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 1.6720 7.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7000 1.0210 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9510 1.3170 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 0.3020 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -2.7360 -5.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -2.4660 -6.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -1.1420 -4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 26 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 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 M END