MMs03131852 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 47 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 1.5000 -0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2566 1.2875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2433 -1.3105 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4867 -2.6057 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8867 -1.5665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0133 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7699 -3.8932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2301 -3.9085 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0301 -3.9085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7301 -3.9162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1301 -4.9554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4734 -5.2190 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0734 -6.2583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7168 -6.5142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4602 -7.8171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9734 -5.2267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4867 -2.6210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9867 -2.6286 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3867 -1.5894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7433 -1.3335 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3433 -0.2942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2433 -1.3411 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4433 -1.3411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9866 -2.6440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -3.9391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7300 -3.9315 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9734 -5.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2168 -6.5372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 -0.0306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4735 -5.2037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0061 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0061 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4433 -1.3166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6079 -1.5558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8015 -5.7382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7936 -7.2809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8549 -8.8532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5681 -6.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1866 -2.6501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1999 -0.0520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6052 1.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2735 -5.1976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4734 -5.2496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0680 -6.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 30 43 1 0 0 0 0 31 44 1 0 0 0 0 32 45 1 0 0 0 0 46 47 1 0 0 0 0 M END