MMs02748751 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.9159 -1.1879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4026 -0.9886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3185 -2.1765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7478 -3.5637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8052 -1.9773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7212 -3.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2079 -2.9659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7787 -1.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8627 -0.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -0.5901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2654 -1.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9780 -0.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4535 -0.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6528 -1.8162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3004 -2.4651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9727 -2.5289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2498 -1.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6370 -2.3129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9906 -3.7707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6085 -1.1700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.8218 0.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3925 1.4942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3640 -0.2465 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.1041 -1.2842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9509 -0.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4465 -0.1603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9503 0.7327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7327 0.9503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9503 -0.7327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1472 -1.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2794 -2.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2645 -4.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9406 -3.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3194 0.7189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6433 0.3602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4589 1.0223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3221 0.4986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0069 -3.7284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8064 -2.4467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1972 -1.7793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4317 1.0358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9656 -1.2422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1239 0.8303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 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 11 2 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 M END