MMs01677038 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.2964 0.7545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 0.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2013 -1.4820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5029 -2.2275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7994 -1.4731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1010 -2.2186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0269 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8313 0.6305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4926 0.7724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4874 2.2724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2476 -3.7056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7537 -3.8415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1245 -5.2032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7631 -6.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -7.7921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4123 -7.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7737 -6.3093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6298 -5.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1122 -4.9314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4829 -6.2930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6060 -4.7955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2352 -3.4338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7291 -3.2980 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5937 -4.5237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9644 -5.8853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4706 -6.0212 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0875 -4.3878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9049 -2.2365 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6036 1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0372 -0.6036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6036 -1.0372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5219 1.6711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0646 1.6764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8299 -0.9129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3726 -0.9076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 1.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6627 1.6854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8542 -2.6458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1736 -3.6883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9589 -6.6609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4179 -8.8780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7274 -8.6519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5779 -6.2089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1189 -3.9918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5435 -2.4533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6561 -6.8659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1962 -5.5829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2826 -4.2791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9788 -3.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8636 -1.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9069 -2.8365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END