MMs01659246 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 1.5000 -0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 -1.3018 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0484 -1.3018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4968 -2.5999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7484 -1.3036 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9484 -1.3036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 1.2945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 -1.3073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2484 -1.3091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2516 1.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5032 2.5852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0032 2.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2516 1.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7516 1.2908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4968 -2.6036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7452 -3.9017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2452 -3.8999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4936 -5.2016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0015 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2931 1.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6281 0.4072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4583 -1.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8956 -3.6384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5353 -3.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6203 -1.7163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9553 -2.4893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0386 -2.4906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3755 -1.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0987 -1.0528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4516 1.2838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1044 3.6237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4044 3.6270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6245 1.7026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9614 2.4723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6968 -2.6050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8924 -6.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6936 -5.2031 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 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 19 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 M END