MMs02087958 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 62 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 -0.0068 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3092 -2.2441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -3.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6184 -4.4882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6252 -5.9882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9344 -8.2323 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9344 -9.4323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2368 -8.9764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5325 -8.2205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5257 -6.7205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8349 -8.9646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1305 -8.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5036 -8.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5022 -7.6934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7464 -6.3978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2806 -6.7163 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -11.4905 -5.0953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9904 -5.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7463 -6.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0022 -7.6866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8221 -10.2784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7119 -11.2872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2508 -10.7355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5693 -12.2013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9979 -12.6584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6388 -8.9881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3364 -8.2440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0054 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1759 -1.2970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3985 -2.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7145 -1.1146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4919 -2.4471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1333 -3.5411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9107 -4.8736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0237 -3.3587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8011 -4.6912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4425 -5.7852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2199 -7.1177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4697 -9.8991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0123 -9.8921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8403 -10.1646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3610 -4.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6935 -3.9126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7767 -3.9077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1162 -4.6730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6621 -5.6087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6691 -7.1514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7992 -8.8693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1317 -8.0919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3702 -12.2486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4076 -13.3904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3636 -11.5154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1409 -13.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6323 -13.8013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9276 -6.7323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9641 -6.1276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6456 -10.4881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6091 -11.0928 0.0000 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 58 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 27 1 0 0 0 0 7 58 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 2 0 0 0 0 27 60 1 0 0 0 0 58 59 1 0 0 0 0 60 61 1 0 0 0 0 M END