MMs01958685 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 0.7412 -1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0453 -0.5629 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6210 -0.1387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0554 0.9370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3595 1.6782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6535 0.9194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9575 1.6606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6433 -0.5805 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.6825 0.0195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3392 -1.3217 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3290 -2.8217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0249 -3.5628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -2.8041 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7310 -4.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5731 -3.5452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6331 -2.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9372 -1.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2413 -0.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5352 -1.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5251 -2.8569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8190 -3.6157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1231 -2.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4170 -3.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7211 -2.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7313 -1.3922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0354 -0.6510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4373 -0.6334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1332 -1.3745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8393 -0.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7588 -1.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5216 0.2965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5929 1.0433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0433 -0.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4639 0.8369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6527 2.0674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5944 2.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1371 2.5922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9927 1.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9657 2.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5122 -2.6213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7318 -3.9521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -4.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2474 -4.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6082 -2.9382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0261 -3.1156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6683 -2.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2401 -1.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1596 -2.2533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7023 -2.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4818 -3.4498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8108 -4.8157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4089 -4.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7562 -3.4992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8475 0.5842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7507 -0.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9588 -1.2858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7669 -2.4939 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 14 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 30 2 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 29 2 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END