MMs01968286 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.0054 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3072 -2.2453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2909 -2.2547 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5926 -1.5094 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5926 -2.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7548 -0.0182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7552 1.1001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2239 2.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6922 2.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6919 1.7132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2232 0.2883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9684 -1.0134 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9607 -2.1245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2672 -3.5929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4596 -1.1757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0648 -2.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5560 -2.7104 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.7182 -1.2192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3938 -4.2016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0472 -2.8726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6523 -4.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1435 -4.4073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0296 -3.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4245 -1.8245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9333 -1.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0044 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2865 -3.4547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5805 0.8549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4242 3.4197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0672 3.9715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8665 1.9584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3803 0.0217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6250 -0.8896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8994 -2.8343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1441 -3.7456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9434 -5.2134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6276 -5.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2225 -3.3268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1333 -0.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4492 -0.5643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 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 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 M END