MMs03349718 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 54 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 1.3026 -0.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3098 -2.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6124 -2.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6196 -4.4875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9222 -5.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2895 -4.6147 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5334 -3.4397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2986 -5.7246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5548 -7.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0861 -6.7223 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.9762 -7.7313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5474 -7.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2285 -5.8089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2003 -5.3522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3102 -6.3612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9913 -7.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4375 -8.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7564 -9.7494 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -8.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5672 -9.6252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 -8.3155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5547 -7.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0547 -7.0057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7985 -5.7174 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5423 -4.4148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5672 -9.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0421 0.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -1.0421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3026 0.4562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2030 -1.0239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6344 0.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9931 1.0488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -2.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9047 -3.3733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0174 -1.8580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7951 -3.1903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5832 -5.0925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 -8.4656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4179 -8.7936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1164 -5.0017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4554 -4.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4532 -5.9959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8792 -8.6342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5844 -5.0098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1374 -3.3727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5002 -3.8198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5308 -10.2159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1721 -10.6472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6035 -9.0059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 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 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 12 1 M END