MMs02478180 MOE2007 2D CORINA 3.40 0006 02.08.2006 83 85 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 0.7398 -1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2397 -1.3166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9795 -2.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2194 -3.9146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4795 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2397 -1.3402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7396 -1.3519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4794 -2.6568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9794 -2.6686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7395 -1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9997 -0.0706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 -0.0588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2395 -1.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 -0.0941 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5996 -1.1333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4996 -0.1058 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6996 -0.1058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2394 -1.4107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7393 -1.4225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.4995 -0.1294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9994 -0.1411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7596 1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7392 -1.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4791 -2.7274 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.7840 -1.9876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1742 -3.4671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2189 -4.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4588 -5.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1985 -6.6302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6985 -6.6420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4587 -5.3489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7189 -4.0440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4383 -7.9469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2597 1.1873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2598 1.2108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0200 2.5039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5200 2.4922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2802 3.8088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0404 5.1019 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8404 5.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5333 5.2470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8567 6.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5636 7.4719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4410 6.4770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0439 0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5918 1.0439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0439 -0.5918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -1.7064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9389 -2.4882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2619 -3.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6039 -3.0525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8713 -3.6913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5712 -3.7125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6079 0.9639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9079 0.9851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0218 -2.5673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3638 -1.8065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1086 -1.8123 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4385 -2.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3751 0.2899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7171 1.0507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1994 -0.1411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7941 0.5439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3677 2.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7251 1.7601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2173 -1.7419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3311 -2.4899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7831 -0.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2588 -5.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5904 -7.6647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6586 -5.3583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3270 -3.0095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8302 -8.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6383 -7.9563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4597 1.1779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0599 1.2202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5239 4.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7257 5.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9950 6.3320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3534 7.8041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3971 5.8851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7433 7.4533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 1 48 1 0 0 0 0 2 3 1 0 0 0 0 2 49 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 51 1 0 0 0 0 6 52 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 53 1 0 0 0 0 10 11 1 0 0 0 0 10 54 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 55 1 0 0 0 0 13 56 1 0 0 0 0 14 15 1 0 0 0 0 14 57 1 0 0 0 0 14 58 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 19 59 1 0 0 0 0 19 60 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 61 1 0 0 0 0 21 62 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 63 1 0 0 0 0 23 64 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 24 69 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 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 70 1 0 0 0 0 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