MMs02252989 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 -0.4979 -1.4149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4361 -2.9137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8423 -3.4356 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9938 -4.2841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6732 -4.6845 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5218 -5.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1177 -4.2801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1796 -2.7814 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1796 -1.5814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7733 -2.2595 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0839 -1.1004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9424 -1.0106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4284 -1.9505 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4903 -0.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9347 -0.0475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7656 -1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8347 -2.4725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3878 -3.8668 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.9900 -3.0833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8718 -4.0849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8028 -2.9088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2497 -1.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1806 -0.3383 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.4249 -5.4792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1513 -6.0907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1082 -7.2459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9871 -1.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -0.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3983 1.1320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 0.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5493 0.2930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6121 -5.6538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6801 -6.4201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1159 -5.4842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3742 -7.0051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6906 -8.3709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1564 -2.3913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1751 -1.0339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8177 -0.0153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 26 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 33 1 0 0 0 0 25 34 1 0 0 0 0 26 27 1 0 0 0 0 26 35 1 0 0 0 0 26 36 1 0 0 0 0 27 37 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 M END