MMs01153745 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 56 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 -1.3733 -0.6033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5375 -2.0943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3284 -2.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -2.3787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2091 -0.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5825 -0.2844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9016 1.1813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3941 1.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9974 -0.0426 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8778 -1.0408 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1506 2.6260 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9506 2.6260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 3.9287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1634 5.2241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6634 5.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 3.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6505 2.6186 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3941 1.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6377 0.0205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8941 1.3084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6376 0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1376 -0.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0253 1.2074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4496 0.7368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4421 -0.7632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0133 -1.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9108 -2.6976 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1313 1.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3406 0.1068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4597 -4.1748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0123 -3.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4839 3.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 4.7046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0378 5.6401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3776 6.4048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4609 6.3994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7930 5.6215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3300 4.6807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3224 3.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6916 2.4912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0237 1.7133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5080 -0.3991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8402 -1.1771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5376 -1.0410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9890 1.8126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5188 2.3012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7049 1.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6424 0.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6362 -0.6436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6858 -1.9381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9711 -1.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4959 -2.3183 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 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 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END