MMs01930115 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 0.4815 -1.4206 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3848 -2.6452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5121 -3.8475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9327 -3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9138 -1.8661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2033 -1.0998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1844 0.4001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5117 -1.8334 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5306 -3.3332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -4.0668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2411 -4.0996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -5.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8011 -1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1095 -1.8006 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1095 -0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4721 -1.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4897 -2.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7562 -3.5836 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2851 -3.2903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9794 -2.0996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5722 -0.7217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0619 -0.5461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9588 -1.7484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3660 -3.1263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8763 -3.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2836 -4.6798 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1365 0.3852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3852 1.1365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1365 -0.3852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5847 -2.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0601 -5.6146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2752 -6.7993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4599 -5.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0183 -0.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5608 -0.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 -0.1417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4339 -0.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8547 0.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5361 0.5562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1505 -1.6079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0835 -4.0882 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 6 1 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 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 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 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 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 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 M END