MMs01590735 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 48 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 -1.3018 0.7452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3074 2.2452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0111 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2907 2.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2962 0.7548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5869 3.0096 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.6092 2.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9054 2.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2073 2.9807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2128 4.4807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5035 2.2259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8053 2.9710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1016 2.2162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 0.7162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7942 -0.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4979 0.7259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3922 -0.0386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6940 0.7066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9903 -0.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9847 -1.5482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2921 0.6969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -15.6601 0.0818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6680 1.1927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9228 2.4946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4544 2.1881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3388 0.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 4.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3377 0.1587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6137 4.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9010 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8098 4.1710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1430 2.8124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7897 -1.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4565 0.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9261 1.6287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4688 1.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0563 -0.9552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6283 -0.6272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4676 0.2980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.6414 1.8945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0209 2.9786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5562 3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2544 2.1926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3334 3.3820 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END