MMs01392503 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0012 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2972 -2.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3008 -2.2490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5993 -1.4979 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5993 -2.6979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9701 -2.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2831 -3.5739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9729 -0.9914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2218 0.3070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8309 1.6778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7549 -0.0060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4648 -1.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3455 0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7343 1.4370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8374 -0.0884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7181 1.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2100 0.9702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8212 -0.3996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9405 -1.6138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4486 -1.4582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3131 -0.5552 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.1575 -2.0471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4687 0.9367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8050 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4162 -2.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9081 -2.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7889 -1.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1777 0.3478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6857 0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8981 -1.2123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -2.8519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6964 -3.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5302 -3.1688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0729 -3.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8625 0.7962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1349 -2.3008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5438 -1.6722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6391 1.6510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0480 2.2796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1254 2.1673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3741 1.2615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0195 -2.1390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6107 -2.7676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2845 -1.7495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5333 -2.6552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7117 -3.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3971 -3.3321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9824 -1.1465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8822 1.3192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1968 1.5993 0.0000 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 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 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 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 21 50 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 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 M END