MMs02970579 MOE2007 2D CORINA 3.40 0006 02.08.2006 46 47 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 1.2958 0.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2894 2.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8939 0.7666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0222 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4919 0.7777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4855 2.2777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0900 0.7888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6880 0.7998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9967 -1.4446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2861 0.8109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8841 0.8220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8778 2.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5755 3.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2797 2.3109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9775 3.0554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9724 4.2553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6816 2.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3794 3.0443 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.1864 0.0775 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6044 1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0367 -0.6044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6044 -1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2566 1.3555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4894 2.2606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2843 3.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0894 2.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8306 -0.9115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3733 -0.9049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1186 1.6826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6613 1.6891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2012 -1.1778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0267 -0.8893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5694 -0.8827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3147 1.7047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8574 1.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6248 -0.8782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1675 -0.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5934 -1.1335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9144 2.9264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5704 4.2664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 23 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 M END