MMs03919373 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 54 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 1.2999 -0.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3017 -2.2485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0030 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 -0.7454 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8588 -1.3454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8997 -2.2454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1997 -2.9939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0061 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1961 -1.1939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1944 1.5061 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1944 2.7061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 2.2546 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8553 2.8546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8927 3.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5928 4.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5911 6.0030 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0911 6.0013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0911 6.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5963 1.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4926 2.2576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4961 -0.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0091 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7942 -1.1909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0941 -0.7394 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1334 -1.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0122 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4315 0.6122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3905 1.5122 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3905 2.7122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0906 2.2606 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0514 2.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7925 1.5091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0889 3.7606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 4.5121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6887 2.2637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6922 -0.7363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0959 -2.2394 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5988 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 0.5988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5988 -1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5974 0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8612 -2.8467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0747 3.5476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3018 4.8827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5564 2.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 3.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7286 1.6649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6936 -1.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1358 -2.8381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5893 7.5030 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 4.5091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7876 5.7091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5494 8.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 51 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 33 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 38 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 37 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 36 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 31 34 1 0 0 0 0 34 35 2 0 0 0 0 34 52 1 0 0 0 0 36 48 1 0 0 0 0 37 49 1 0 0 0 0 38 50 1 0 0 0 0 51 54 1 0 0 0 0 52 53 1 0 0 0 0 M END