MMs03082786 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 63 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 2.5980 0.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8932 0.7703 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8539 1.3703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2039 -1.4729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5068 -2.2161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8019 -1.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 0.7838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 0.7974 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4188 2.1392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 2.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5962 3.9908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6652 5.0430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1110 4.6434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4878 3.1915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8189 2.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5726 1.0204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7308 0.0672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1354 0.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3817 2.0734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2234 3.0265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0701 -0.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5674 -0.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2379 -2.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4110 -3.2631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9137 -3.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2433 -1.8309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7975 -1.4313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8590 -2.1791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1625 -0.7008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1049 -2.2026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8853 2.2703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6054 1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0361 -0.6054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6054 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3742 -0.9017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8315 -0.9097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1678 -2.0783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5131 -3.4161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4849 1.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1178 1.6970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4396 4.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3637 6.2045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9662 5.4852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5053 2.4946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4205 4.2102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2289 0.3315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4357 -2.0838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9474 -4.3365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2523 -4.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2298 -1.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1111 -3.4026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8430 2.8649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2951 0.7568 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5190 1.6720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0617 1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 56 1 0 0 0 0 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 34 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 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 20 21 1 0 0 0 0 20 30 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 32 53 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 56 57 1 0 0 0 0 56 58 1 0 0 0 0 M CHG 1 18 1 M CHG 1 56 1 M END