MMs00245289 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.4717 -0.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9563 -1.7097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4279 -1.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4150 -0.8704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9304 0.5492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4588 0.8393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8867 -1.1605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9864 -0.1404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2964 -0.8711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5842 -0.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 1.3979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2520 2.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9642 1.3594 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8942 -0.8326 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.1820 -0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4920 -0.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5142 -2.2940 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7798 -0.0250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.0898 -0.7557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3776 0.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7568 -0.5763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7439 0.5531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9748 1.8409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5123 1.5074 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0063 -2.3428 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5170 -2.5216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2321 1.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1773 0.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2321 -1.1773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1666 -2.6132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8156 -3.1355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7201 1.4528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0711 1.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2343 3.3285 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3972 0.8443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9397 0.8671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7621 1.1748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3322 -1.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8747 -1.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0236 -1.7463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9391 0.4454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4466 2.9443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 27 2 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 M END