MMs02210418 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 42 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 1.3055 -2.2463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8992 -0.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4973 -0.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0954 -0.7240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6934 -0.7166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2915 -0.7091 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2958 -2.2091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9860 1.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2829 2.2909 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5841 1.5446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5970 1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0409 0.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -1.0409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1055 -2.2497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3089 -3.4463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5055 -2.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3668 0.9289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8241 0.9245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1305 -1.6603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6732 -1.6559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4222 0.9319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9648 0.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7286 -1.6529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2713 -1.6485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0202 0.9393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5629 0.9437 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3267 -1.6454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8693 -1.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6183 0.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1610 0.9512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9247 -1.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4674 -1.6336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3367 -2.8062 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9451 2.1342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6216 2.1475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3012 -0.7463 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2619 -1.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 42 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 41 1 0 0 0 0 42 43 1 0 0 0 0 M CHG 1 42 1 M END