CHEMDIV-ZINC06901540 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 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 0.2810 -0.1900 4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.8360 5.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -0.0260 6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 1.0660 6.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 0.9590 5.5280 O 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 1.9850 -0.1920 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -0.7780 -2.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -1.4970 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -1.2780 -2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -1.8510 -2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -2.6260 -3.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -2.8410 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.2810 -4.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -3.8370 -5.8060 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.3260 -6.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 -4.6850 -5.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 -2.8280 -6.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.1910 -7.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -2.5000 -9.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4310 -2.0700 -9.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -2.8600 -8.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -2.5590 -7.0790 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 -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 -1.1350 -1.7890 5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -0.2420 7.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 1.8880 7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 0.4160 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -0.7280 -3.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -1.6890 -1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -3.0700 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -2.4550 -5.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -1.1120 -7.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 -2.5840 -7.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -1.9550 -10.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -3.5710 -9.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -1.0050 -9.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.2670 -10.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -2.5700 -8.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1830 -3.9260 -8.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3630 -3.1940 -6.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -1.5110 -6.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 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 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END