MMs01958714 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 0.9924 -1.1248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5146 -2.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9557 -2.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9481 -1.7190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4703 -0.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3245 -2.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1827 -3.8085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7187 -4.1351 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2417 -5.2362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6159 -1.5522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9225 -2.2891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2139 -1.5261 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5903 -2.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9169 -3.5864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5827 -0.9976 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.1827 -2.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8197 0.2938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3557 -0.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2309 0.9596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0760 -1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9454 0.0829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4387 -0.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0626 -1.4230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.3081 1.1634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.8303 2.5853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0349 3.4791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2572 2.6097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8081 1.1785 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -16.9672 1.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.7019 -0.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1920 0.1457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3823 1.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1687 -0.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3085 -3.4464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2642 0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0825 -4.6025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8354 -0.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3780 -0.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1604 -3.2161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7030 -3.2006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2967 1.3949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7568 -2.2962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1598 -1.6546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8616 0.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2646 1.2397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7390 2.0862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2199 3.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2230 4.3628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.8288 4.3789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.8467 3.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.3583 2.1327 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.6287 -0.5629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.0442 -1.1762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.9071 -0.8180 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 19 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 21 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 M END