MMs01004876 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 1.4729 0.2838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1091 1.6422 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5976 1.4570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7312 2.4392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1487 1.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4325 0.4757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2989 -0.5066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8814 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5683 -0.7410 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 -0.0150 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3407 1.4025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3593 -1.4325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2675 -0.5057 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4012 0.4766 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4012 -0.7234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1173 1.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2510 2.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9672 4.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6685 2.4411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8186 -0.0141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9523 0.9682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1024 -1.4870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4609 -2.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2756 -3.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8027 -3.8955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0777 -2.5824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 1.1783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1783 -0.2270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -1.1783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5042 3.6176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0557 2.7344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5259 -1.6849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4945 -1.6840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9963 1.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 2.9791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0995 3.7803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1455 4.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7402 5.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7889 4.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2760 1.3071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8025 2.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0610 3.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8534 -0.9892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6297 -2.3950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4754 -3.6346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3783 -4.8073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1517 -5.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6974 -4.3625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2919 -1.6754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0936 -3.2690 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 10 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 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 27 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 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 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END