MMs02408095 MOE2007 2D CORINA 3.40 0006 02.08.2006 78 82 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 1.2960 -0.7553 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2898 -2.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -0.7659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2022 1.4788 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9063 2.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6042 1.4894 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3067 -1.0294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -2.3972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1999 -2.2344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7752 -0.7236 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1752 0.3157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8858 -1.7318 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7343 -2.5803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1879 -0.9871 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0364 -0.1386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8820 0.4814 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2820 1.5206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3909 0.6443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8903 1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4326 3.0205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5557 -1.6028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7728 -0.7261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6221 0.7663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1407 -1.3418 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.2921 -2.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3578 -0.4650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2071 1.0274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4242 1.9041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2735 3.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9056 4.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6885 3.1355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8392 1.6431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7549 5.5046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9721 6.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2914 -2.8342 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6592 -3.4499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8763 -2.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2441 -3.1888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4612 -2.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3105 -0.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9427 -0.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7256 -1.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5276 0.0570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8954 -0.5587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7229 -3.2229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6042 1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0368 0.6042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6042 -1.0368 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0899 -2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -3.4553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4898 -2.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9112 3.4341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2868 -3.4389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6252 0.6434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9521 2.1510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2391 3.9090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6763 -2.7967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8794 -1.5457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5126 -0.1390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5184 1.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2472 4.0979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5943 3.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3524 1.2924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6734 5.4076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9457 7.0827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2707 7.3550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7797 -4.6438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3647 -4.3828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5555 -2.8047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8221 0.9899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1785 -0.8344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.4029 -1.6529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.9897 -1.0512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3880 0.5356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6247 -3.7065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 49 1 0 0 0 0 1 50 1 0 0 0 0 1 51 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 52 1 0 0 0 0 3 53 1 0 0 0 0 3 54 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 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44 45 1 0 0 0 0 44 73 1 0 0 0 0 45 74 1 0 0 0 0 46 47 1 0 0 0 0 47 75 1 0 0 0 0 47 76 1 0 0 0 0 47 77 1 0 0 0 0 48 78 1 0 0 0 0 M END