MMs00027456 MOE2007 2D CORINA 3.40 0006 02.08.2006 66 69 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 1.3005 0.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5950 -1.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2945 -2.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 0.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9016 2.2421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0105 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1569 -0.6105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1931 -1.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4967 0.7369 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4575 1.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4997 2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8003 2.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0978 2.2317 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3983 2.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6959 2.2264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6928 0.7264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1185 0.2600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0026 1.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1234 2.6871 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.5026 1.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2500 0.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7500 0.1652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5026 1.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7552 2.7633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.2552 2.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0209 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4315 -0.6209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0948 0.7317 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0948 -0.4683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0157 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9457 -0.8642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7912 -1.5157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3893 -1.5209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0485 3.7309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5979 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -0.5202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5311 1.6682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0737 1.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1861 -1.4022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0032 -2.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9955 -1.7324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2541 -2.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8924 -3.2930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5931 -1.5093 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1907 -2.7105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3931 -1.5129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3175 2.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0916 3.3654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0308 3.9051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5735 3.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6288 3.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1715 3.8968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6479 -0.8698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3479 -0.8752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7026 1.4603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6573 3.8067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8292 -2.1178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1893 -1.5185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3868 -2.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5893 -1.5234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2478 3.7703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0090 4.9302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8491 3.6914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 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 42 1 0 0 0 0 4 43 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 58 1 0 0 0 0 26 27 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 M END