MMs02514443 MOE2007 2D CORINA 3.40 0006 02.08.2006 79 80 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 1.3025 -0.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3093 -2.2440 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4986 -0.7202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7873 1.5357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0966 -0.7083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3853 1.5476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6809 2.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9834 1.5595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6947 -0.6964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2790 2.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2721 3.8154 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3113 3.2154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5677 4.5714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5608 6.0714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8701 3.8273 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.1657 4.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4682 3.8392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4751 2.3393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7638 4.5952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0662 3.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3618 4.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6643 3.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9599 4.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9530 6.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6505 6.8630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3549 6.1071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9696 4.5595 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9628 6.0595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2583 6.8154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6603 6.8035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6534 8.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6465 9.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1534 8.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1534 8.3104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 0.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5952 -1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8225 0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3652 0.9347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1334 -1.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6761 -1.6478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4205 0.9395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9632 0.9466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7314 -1.6430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2741 -1.6359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1021 -1.9083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3434 2.1428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6754 3.5035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0322 -0.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7002 -1.8964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6945 1.1897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4598 2.5292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8756 2.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3902 5.4990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9328 5.5061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2991 2.9284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.8418 2.9354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6698 2.6631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.0018 4.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.9895 6.7237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.6450 8.0630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3130 6.7023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9332 3.9547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2465 9.8062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6410 11.0035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0466 9.8007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1507 8.8966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9534 8.2911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1589 7.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1589 7.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3534 8.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1507 8.9104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 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