MMs01108168 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 65 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 0.7509 1.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2509 1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2491 -1.3007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7491 -1.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2509 1.2952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7509 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7491 -1.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2491 -1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0066 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8808 -1.2207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4162 -2.6470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3077 -0.7582 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.3077 -1.9582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7340 -1.2228 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.8931 -1.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6165 -0.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7357 1.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3088 0.7418 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2696 0.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8826 1.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4201 2.6332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2131 1.4636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2914 0.4209 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4230 2.9489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6671 3.7868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5636 5.2832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2159 5.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9717 5.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0753 3.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0325 2.5292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5472 2.7390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1964 -2.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6634 -2.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1259 -4.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1214 -5.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6544 -5.1906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1919 -3.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5839 -6.9305 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1517 2.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8517 2.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8483 -2.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1483 -2.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6517 2.3349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3517 2.3329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3483 -2.3436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6483 -2.3417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7453 3.2599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5589 5.9535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1330 7.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8935 5.6307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4670 -2.0715 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2995 -4.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8508 -6.0818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0183 -3.5134 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 43 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 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 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 51 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 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 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 56 1 0 0 0 0 38 39 1 0 0 0 0 38 57 1 0 0 0 0 39 40 2 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 40 58 1 0 0 0 0 41 59 1 0 0 0 0 M END