MMs01688617 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 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 0.7564 -1.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0128 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4872 -2.6054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2436 -1.3101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7092 -1.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8587 -3.1218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4853 -3.7251 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2301 -4.8976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8289 -0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2532 -1.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3728 -0.1034 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.7971 -0.5740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1017 -2.0427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9168 0.4242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3410 -0.0464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4607 0.9518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8850 0.4812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1028 1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3120 0.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8414 -0.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3415 -0.9476 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5949 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9564 -1.2894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6179 -3.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1051 1.0289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8949 -3.7269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8869 0.1124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3975 0.4257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6846 -2.1584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1951 -1.8451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1291 1.0716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9748 1.1676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4853 1.4809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7724 -1.1031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2830 -0.7898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5187 1.6953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0293 2.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1088 2.5569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4551 0.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5420 -1.9293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 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 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 M END