MMs01073532 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 39 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 0.7453 1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2547 -1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7547 -1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0163 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9000 -1.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2453 1.3181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4906 2.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9906 2.6089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2547 -1.2800 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7547 -1.2746 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7601 -2.7746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7492 0.2254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2547 -1.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2546 -1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5093 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0094 -2.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7546 -1.2528 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.5093 -2.5491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4999 0.0489 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1415 2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5434 1.8279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8585 -2.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1585 -2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1673 0.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1617 2.0927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6584 -2.3214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3962 1.0697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0962 1.0795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1131 -3.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4131 -3.6068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2358 3.9161 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6321 4.9532 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END