MMs01896595 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 0 0 0 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 -0.0095 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2848 -2.2582 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5885 -1.5164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0164 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8828 -2.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1866 -1.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4808 -2.2910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7846 -1.5492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0789 -2.3074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 -0.0657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6769 -2.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8733 -3.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1676 -4.5327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5696 -4.5163 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2753 -3.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0284 -4.4999 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 -6.0163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2564 -6.7581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0076 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0076 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1899 -1.2841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -2.6250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1942 -0.3328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4733 -3.4910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0191 -0.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5617 -0.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3017 -3.2218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8444 -3.2315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5921 -0.0733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3997 1.1343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1921 -0.0581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0703 -3.3592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7123 -2.9304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2834 -1.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7432 -5.8154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9634 -7.1465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6629 -5.7151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2134 -7.3515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8498 -7.8011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3826 -1.5656 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 42 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 42 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 M END