MMs01013493 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 1.5000 0.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2458 1.3063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4916 2.6029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0084 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7542 1.2966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4766 4.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7341 4.9087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9505 4.0310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3755 4.4992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4935 3.4991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1864 2.0309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9186 3.9672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0365 2.9672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4616 3.4353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7687 4.9035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6508 5.9036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2257 5.4355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7292 6.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9399 7.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4717 8.7194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0283 8.7146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4872 7.2865 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5966 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1034 -1.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4458 1.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9542 1.2927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 4.3903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8087 5.5569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3187 5.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0933 2.2253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6033 1.9095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6325 2.2475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6610 3.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8828 4.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4013 5.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5940 6.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 6.9613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0263 5.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0548 6.6232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0823 6.9272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1739 9.6925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7368 9.6831 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 M END