MMs03293289 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 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 1.2949 -0.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -0.7712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -0.7853 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4910 0.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0891 -0.7994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0565 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3922 -1.2565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7591 -0.6740 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9182 -0.9846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2149 -2.1031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6804 -2.4229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1362 -3.8520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6017 -4.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6114 -3.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1557 -1.6335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6901 -1.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2344 0.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7689 0.4352 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.3689 1.4745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0259 1.7383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5570 1.4345 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8676 2.5936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4478 2.4442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7037 3.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1654 -0.5243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6309 -0.8441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6406 0.2652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1849 1.6942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4829 -2.2853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4404 -2.8796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6056 1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 0.6056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6056 -1.0360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5186 -1.6721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0613 -1.6805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8317 0.9093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3744 0.9009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1167 -1.6862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6593 -1.6946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4297 0.8952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9724 0.8868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0278 0.8811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5704 0.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3127 -1.7144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8554 -1.7228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0257 -2.2636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1665 -3.3021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3284 -4.7394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9663 -5.3151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7838 -3.3185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4236 0.2760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2828 1.3144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1248 2.2205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6613 2.8816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1753 -1.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6451 -1.4855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1061 -0.0547 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 38 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 33 1 0 0 0 0 8 9 1 0 0 0 0 8 46 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 53 1 0 0 0 0 18 19 2 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 21 56 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 32 2 0 0 0 0 31 61 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 61 -1 M END