MMs00029309 MOE2007 2D CORINA 3.40 0006 02.08.2006 77 81 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 1.2984 -0.7510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2972 -2.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5957 -3.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8953 -2.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8965 -0.7531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1937 -3.0042 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9448 -1.7058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4427 -4.3026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4922 -3.7552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7918 -3.0063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1616 -3.6175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1662 -2.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4173 -1.2040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9498 -1.5146 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1683 0.0945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6683 0.0933 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.2441 0.5175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4173 -1.2064 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6662 -2.5048 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0662 -3.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4152 -3.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6641 -5.1029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1641 -5.1017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4131 -6.4025 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6620 -7.7010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2710 -9.0718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1555 -10.0746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8571 -9.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1701 -7.8565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9173 -1.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6683 0.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9194 1.3905 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.1194 1.3905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4194 1.3917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4206 2.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1209 2.1427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1221 3.6427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6704 2.6889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1662 -2.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6008 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 0.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6008 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2575 -2.8502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5947 -4.2021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9362 -0.1540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 1.1979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4912 -4.9552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0410 0.5058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2730 0.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3351 -3.0338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3338 -4.5765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6131 -6.4035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8620 -7.7010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3107 -8.4726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9756 -10.0432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0466 -10.8782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4494 -11.0448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3681 -10.4194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7161 -8.9518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1711 -6.6565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9768 -7.7301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7079 -2.3892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0446 -1.6189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5870 -0.6812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 0.8614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6206 2.8907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4215 4.0917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2206 2.8927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9153 1.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9393 2.3521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0834 4.2436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8704 2.6880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1265 -3.1052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7654 -3.5457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2059 -1.9069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 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