MMs01596985 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4921 -0.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3716 1.0609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8637 0.9067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4762 -0.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5966 -1.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1045 -1.5234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9682 -0.6168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7205 -1.9145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1872 -1.6001 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3413 -0.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9700 0.4997 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6391 0.6442 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.9394 -0.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2371 0.6487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2345 2.1487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5375 -0.0990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8352 0.6533 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.8352 -0.5467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8326 2.1533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1356 -0.0945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1382 -1.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4385 -2.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7362 -1.5899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7336 -0.0899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4333 0.6578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4307 2.1578 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 20.0366 -2.3377 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1234 1.1936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1936 0.1234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1234 -1.1936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8816 2.1563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5673 1.8787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0866 -2.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4009 -2.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1697 -1.0241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7124 -1.0214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5396 -1.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0326 2.1554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8305 3.3533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6326 2.1512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1000 -2.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4406 -3.5422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7718 0.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 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 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 M END