MMs01818328 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 36 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 1.4959 0.1110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -1.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8533 -0.4661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7423 1.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2853 1.3865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8873 1.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2990 1.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5389 2.3359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5849 3.8352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7249 1.4175 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2179 0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7186 0.0517 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4038 -0.9127 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6438 -0.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2242 1.3715 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0555 -0.5756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3223 -2.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7340 -2.5587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8789 -1.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6122 -0.1135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2004 0.3935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9337 1.8696 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.0888 1.1967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1967 -0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0888 -1.1967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1796 -2.1995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8737 -1.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6738 3.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4063 -2.8269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9474 -3.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0083 -1.9952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5281 0.6617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 M END