MMs01959029 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 -0.7453 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2453 -1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2547 1.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7547 1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2547 1.2800 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8547 2.3193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5094 2.5818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2641 3.8781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7547 1.2746 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5000 -0.0272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7453 -1.3235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 -0.0326 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.3999 -1.0718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7546 1.2637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2546 1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 -0.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2452 -1.3398 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7452 -1.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9905 -2.6415 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.6888 -3.3868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2923 -1.8962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7358 -3.9432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2358 -3.9487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9811 -5.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2264 -6.5467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7264 -6.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9811 -5.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1415 -2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8415 -2.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5566 1.8094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1585 2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2873 -1.1973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6261 -0.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3584 2.3116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6285 1.6782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9673 2.4447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0505 2.4408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3837 1.6646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9220 0.7246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9164 -0.8181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6161 -1.7407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9493 -2.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8396 -2.9116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.1811 -5.2548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8226 -7.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1226 -7.5784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7811 -5.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0094 2.5872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4132 3.6286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 M END