MMs01246959 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 1.2955 -0.7561 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2955 0.4439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8935 -0.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8865 -2.2683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5839 -3.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8889 -4.4809 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3799 -4.6447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9965 -3.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -3.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3649 -4.3452 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 -5.7126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2559 -5.8624 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1055 -1.7601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 -1.6103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2146 -0.2429 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0631 -1.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6832 0.0621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8471 1.5531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4796 2.1697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4707 1.0597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2884 -2.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 -1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 0.9106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3737 0.9034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3093 0.3573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0743 -0.9823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4491 -6.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4047 -0.7859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5087 -2.8070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7610 -1.9061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8031 -1.1319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8832 0.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0196 1.2981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2232 2.6926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0845 3.2061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5121 2.8796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1077 -2.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8727 -3.3818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 23 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END