MMs01068653 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 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 1.1906 0.9125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9956 2.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1862 3.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5717 2.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7666 1.2501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 0.3376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2413 0.9759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0243 -0.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5238 -0.2651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2403 1.0527 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4573 2.3321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1738 3.6499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9578 2.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9259 3.3824 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1453 4.5622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7398 1.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5229 -0.1883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8064 -1.5061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0224 -0.1499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8054 -1.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3049 -1.3909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0214 -0.0731 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2384 1.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7389 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5209 -0.0347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3039 -1.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8034 -1.2757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5199 0.0422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7369 1.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 0.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9524 -0.7300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.9524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1128 2.8596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0302 4.5020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -0.8522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4511 -1.3578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5013 2.2672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8566 1.5303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6886 -1.8685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0440 -2.6053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1268 -2.5776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4427 -1.7723 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3551 1.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9998 2.3824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6011 1.5494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9169 2.3547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7307 -2.3683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4298 -2.2992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7195 0.0729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3101 2.3758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2374 1.2832 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 26 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 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 52 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END