MMs01870391 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7585 1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 2.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2415 1.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2245 3.9117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9206 4.6532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9108 6.1532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3931 6.8947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6872 6.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6774 4.6363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3735 3.8948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5284 3.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5382 1.6703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8225 3.9287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1264 3.1872 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4205 3.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4107 5.4456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7048 6.2041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0088 5.4626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0186 3.9627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7244 3.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7342 1.7042 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 5.2156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9584 1.2863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3204 3.1157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8415 1.3176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1067 -1.0255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9461 6.7600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 8.0947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7304 6.7294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7127 4.0295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3696 3.2948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8147 5.1287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1343 1.9872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3676 6.0388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6970 7.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0440 6.0694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0617 3.3695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3592 6.2509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 25 42 1 0 0 0 0 M END