MMs02529592 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 1.5000 -0.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2466 -1.3049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4933 -2.6019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0067 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7466 -1.3087 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7427 -2.8087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7505 0.1913 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2466 -1.3126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9933 -2.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4933 -2.6175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2466 -1.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7466 -1.3243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4932 -2.6252 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0932 -1.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8796 -3.9940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9917 -5.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6760 -6.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2483 -6.9268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1362 -5.9202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4518 -4.4538 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2927 -4.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6614 -4.8676 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9846 -2.7859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9912 -1.6738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4576 -1.9894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4642 -0.8773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9306 -1.1930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3904 -2.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3838 -3.7329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9174 -3.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0031 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0016 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2947 1.1784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6287 0.4036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6198 -3.0153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2818 -3.7832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 -1.9981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2067 -2.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0098 -3.7981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3906 -3.6513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0906 -3.6583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1027 1.0183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4027 1.0253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3493 -0.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5657 -7.2722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9957 -8.0999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -6.2881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9752 -1.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4436 -0.5623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0963 0.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7358 -0.3033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5635 -2.8733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7517 -4.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1122 -4.3069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 26 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 24 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 55 1 0 0 0 0 31 32 2 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 58 1 0 0 0 0 M END