MMs01523629 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.2929 -0.7605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6101 1.4790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9151 2.2185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2081 1.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8909 -0.7814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4889 -0.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8061 1.4370 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0869 -0.8234 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0748 -2.3233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3678 -3.0838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6728 -2.3443 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6849 -0.8443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9657 -3.1047 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.2053 -4.3977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7262 -1.8118 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2587 -3.8652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5637 -3.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8567 -3.8862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8446 -5.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5395 -6.1256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2466 -5.3652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1375 -6.1466 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6084 1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0344 0.6084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6084 -1.0344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5757 2.0874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9248 3.4184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2521 2.0496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8812 -1.9814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7102 -1.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2528 -1.7278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8948 -2.1054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6553 -3.4476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5890 -3.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1317 -4.0092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8650 -1.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1044 0.2799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6281 0.8416 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1707 0.8291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5734 -1.9258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9007 -3.2946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5298 -7.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2025 -5.9568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M END