MMs01658695 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.2987 -0.7507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2979 -2.2507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0013 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8487 1.2981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3474 -1.3007 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8975 0.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8983 2.2480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1977 2.9974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4963 2.2467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4956 0.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7935 -1.5039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0936 0.7454 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6917 0.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2898 0.7428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6598 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6641 1.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9147 2.5456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4473 2.2345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6005 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 0.6005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6005 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0979 -2.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2973 -3.4507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4979 -2.2513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8593 2.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1983 4.1974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5359 2.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1955 -1.2026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0943 1.9454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6205 -0.9241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1632 -0.9249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9208 1.6637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4635 1.6629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2186 -0.9254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7613 -0.9262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9087 -1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8574 1.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5560 3.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 23 43 1 0 0 0 0 M END