MMs01043739 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 1.3010 -0.7465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8991 -0.7396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9031 -2.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6061 -2.9930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3051 -2.2465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 -4.4930 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.2042 -2.9861 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5012 -2.2326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4972 -0.7326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8022 -2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0993 -2.2257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2521 -0.7335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4986 0.5636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4993 1.6810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8712 1.0745 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7184 -0.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4719 -1.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4712 -2.8321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7870 -4.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6750 -5.3052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2148 -4.7582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5306 -6.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1835 3.1473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5972 1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0408 0.5972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5972 -1.0408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5949 1.2069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9367 -0.1368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2674 -2.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2074 -4.1861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0333 -3.9004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5760 -3.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3048 0.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6657 -1.8369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3575 -6.4772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7832 -7.3977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7037 -5.9719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3566 3.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9309 4.3205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0104 2.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END