MMs02456893 MOE2007 2D CORINA 3.40 0006 02.08.2006 65 67 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 0.7479 -1.3003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0043 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7436 -3.8983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2436 -3.9008 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0086 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5086 -5.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2564 -3.8934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5043 -2.5956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7564 -3.8909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3547 -2.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5086 -5.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7607 -6.4890 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2607 -6.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5129 -7.7917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0129 -7.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7393 -6.4964 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3393 -7.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2393 -6.4989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9871 -7.7992 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4871 -7.8016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -9.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 -9.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4871 -7.8066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7393 -6.5063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2393 -6.5038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9871 -7.8091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7393 -6.5113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 -9.1093 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2350 -9.1118 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6350 -10.1510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9828 -10.4121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4828 -10.4146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2307 -11.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7307 -11.7173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9871 -7.8140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2393 -6.5137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0086 -5.1862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0402 0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5983 1.0402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0402 -0.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6684 -0.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6658 -2.0731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6043 -2.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1146 -8.8300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2232 -8.9756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1141 -8.2065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -5.3168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3676 -6.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3854 -8.8374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6333 -10.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3333 -10.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 -5.4681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6410 -5.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1333 -10.1476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8545 -10.8206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1893 -11.5942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2764 -9.2324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6111 -10.0060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6068 -4.1460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6103 -6.2245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4786 -13.0126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4871 -7.8165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0888 -6.7782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0768 -14.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 2 42 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 44 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 17 1 0 0 0 0 7 8 1 0 0 0 0 7 14 2 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 36 1 0 0 0 0 32 33 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 34 35 2 0 0 0 0 34 62 1 0 0 0 0 36 37 2 0 0 0 0 36 63 1 0 0 0 0 38 60 1 0 0 0 0 38 61 1 0 0 0 0 62 65 1 0 0 0 0 63 64 1 0 0 0 0 M END