MMs02743514 MOE2007 2D CORINA 3.40 0006 02.08.2006 71 75 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 0.7395 -1.3050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2395 -1.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 -0.0241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2394 -1.3412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -2.6341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -2.6221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7393 -1.3532 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1393 -0.3140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7602 1.2448 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5206 2.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7811 3.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5415 5.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0415 5.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7810 3.8187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0206 2.5257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7915 -2.4224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3916 -3.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9396 -4.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5853 -3.5998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3497 -4.4503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4684 -5.9456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8228 -6.5904 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0584 -5.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2434 -2.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6433 -0.6001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2955 -3.1149 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6061 -1.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8957 -4.5607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9478 -5.6298 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3997 -5.2532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4518 -6.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9038 -5.9458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3036 -4.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2515 -3.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7996 -3.8075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7475 -2.7384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5916 1.0440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4083 1.0199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1082 0.9982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0706 -3.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6749 -3.1393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5603 1.2544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3206 2.5377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8557 3.0788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8681 4.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4172 5.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7594 6.3158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8426 6.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1723 5.5250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7064 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6940 3.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8027 1.3456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1449 2.1062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9889 -3.9252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4866 -5.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5378 -3.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -4.1924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -6.6260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1418 -6.2558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3539 -4.3027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1995 -5.5381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1319 -7.4790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7455 -6.8011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4652 -4.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5714 -2.2744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 19 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 21 60 1 0 0 0 0 21 61 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 25 26 2 0 0 0 0 25 64 1 0 0 0 0 26 27 1 0 0 0 0 27 65 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 40 1 0 0 0 0 32 33 1 0 0 0 0 32 66 1 0 0 0 0 32 67 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 34 39 2 0 0 0 0 35 36 2 0 0 0 0 35 68 1 0 0 0 0 36 37 1 0 0 0 0 36 69 1 0 0 0 0 37 38 2 0 0 0 0 37 70 1 0 0 0 0 38 39 1 0 0 0 0 38 71 1 0 0 0 0 39 40 1 0 0 0 0 M END