MMs01438633 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 -1.3021 -0.7447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3082 -2.2447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0122 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2899 -2.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -0.7658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0211 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4921 -0.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -2.2763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0902 -0.7869 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6882 -0.7974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6821 -2.2974 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6405 -2.8932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9781 -3.0527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9720 -4.5526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2802 -2.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7049 -2.7772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5915 -1.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7147 -0.3502 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 14.2863 -0.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0527 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.0826 -1.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6871 -3.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8005 -4.3129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3094 -4.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6102 -2.9894 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8655 -4.2915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3549 -1.6874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9123 -3.7342 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 -4.9491 -3.1300 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 -2.3389 -0.1405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3267 -2.8595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8304 0.9118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3731 0.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -1.6819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6617 -1.6882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2010 1.1789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0266 0.8908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5692 0.8845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6246 0.8802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1673 0.8740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0037 -0.5327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2481 -1.4446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6847 -2.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5172 -3.9695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8770 -4.8433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4651 -5.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1439 -4.4356 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3883 -5.3474 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 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 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 25 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 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 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 30 32 2 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 33 -1 M END