MMs01940465 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 0.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2552 -1.2899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7552 -1.2839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7447 1.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2447 1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4895 2.6041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7552 -1.2717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0105 -2.5738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2552 -1.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1418 -2.4756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5665 -2.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5604 -0.5064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1319 -0.0486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7565 1.0912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7835 -2.8831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6328 -4.3755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8499 -5.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2177 -4.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3685 -3.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1514 -2.2675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3021 -0.7751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6991 -6.7447 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0049 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0049 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6594 -2.3316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3594 -2.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3405 2.3558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5263 3.2083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8853 3.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4527 1.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5957 1.0659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7756 -3.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5385 -4.8680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1914 -5.3381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4627 -2.6517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3964 -0.2826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 24 40 1 0 0 0 0 M END