MMs02745884 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 49 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 0.0097 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2844 -2.2584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3136 -2.2415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6078 -1.4831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9116 -2.2246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9214 -3.7246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6272 -4.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3234 -3.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2253 -4.4662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -5.9661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5194 -3.7077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6665 -2.2150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1317 -1.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8901 -3.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8937 -4.3089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3829 -3.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2566 -2.1156 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.7494 -2.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7458 -1.1415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.1201 -1.7427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4864 -1.1237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7056 -1.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5585 -3.4903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1922 -4.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9730 -3.2355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5078 -3.5569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0078 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8305 -0.5689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3731 -0.5589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3147 -1.0944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0947 -2.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4045 -5.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8619 -5.4073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1403 -3.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9203 -4.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7695 -1.4178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6126 -0.7942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0596 -4.4905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4648 -3.8539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6041 0.0705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7987 -1.5023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5339 -4.1893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0745 -5.3035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 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 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 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 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 M END