D06MXI AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 2.755 0.081 -1.886 1.00 0.00 C HETATM 2 C UNL 1 3.696 1.092 -2.131 1.00 0.00 C HETATM 3 C UNL 1 4.734 1.222 -1.202 1.00 0.00 C HETATM 4 C UNL 1 4.374 0.840 0.085 1.00 0.00 C HETATM 5 C UNL 1 4.044 -0.497 0.077 1.00 0.00 C HETATM 6 C UNL 1 2.996 -0.797 -0.809 1.00 0.00 C HETATM 7 C UNL 1 3.258 1.819 0.641 1.00 0.00 C HETATM 8 C UNL 1 6.123 0.853 -1.680 1.00 0.00 C HETATM 9 N UNL 1 4.883 -1.588 0.471 1.00 0.00 N HETATM 10 C UNL 1 6.193 -1.646 0.984 1.00 0.00 C HETATM 11 O UNL 1 6.901 -0.690 1.263 1.00 0.00 O HETATM 12 C UNL 1 6.743 -3.068 1.220 1.00 0.00 C HETATM 13 C UNL 1 5.806 -4.074 1.247 1.00 0.00 C HETATM 14 C UNL 1 5.346 -4.264 2.534 1.00 0.00 C HETATM 15 C UNL 1 6.319 -4.538 3.494 1.00 0.00 C HETATM 16 C UNL 1 7.639 -4.174 3.187 1.00 0.00 C HETATM 17 C UNL 1 7.832 -3.325 2.070 1.00 0.00 C HETATM 18 CL UNL 1 9.420 -2.763 1.727 1.00 0.00 Cl HETATM 19 N UNL 1 3.990 -4.069 2.842 1.00 0.00 N HETATM 20 C UNL 1 2.949 -3.826 1.897 1.00 0.00 C HETATM 21 C UNL 1 1.538 -4.251 2.353 1.00 0.00 C HETATM 22 O UNL 1 3.117 -3.484 0.746 1.00 0.00 O HETATM 23 C UNL 1 1.702 -5.304 3.226 1.00 0.00 C HETATM 24 C UNL 1 2.224 -6.474 2.619 1.00 0.00 C HETATM 25 C UNL 1 1.997 -6.609 1.241 1.00 0.00 C HETATM 26 C UNL 1 0.993 -5.858 0.668 1.00 0.00 C HETATM 27 C UNL 1 0.703 -4.652 1.300 1.00 0.00 C HETATM 28 CL UNL 1 -0.934 -4.100 1.257 1.00 0.00 Cl HETATM 29 S UNL 1 3.337 -7.162 0.179 1.00 0.00 S HETATM 30 C UNL 1 3.410 -6.015 -1.207 1.00 0.00 C HETATM 31 O UNL 1 4.553 -7.012 0.941 1.00 0.00 O HETATM 32 O UNL 1 2.933 -8.439 -0.325 1.00 0.00 O HETATM 33 H UNL 1 1.951 -0.108 -2.589 1.00 0.00 H HETATM 34 H UNL 1 3.700 1.641 -3.067 1.00 0.00 H HETATM 35 H UNL 1 2.485 -1.753 -0.797 1.00 0.00 H HETATM 36 H UNL 1 3.694 2.801 0.852 1.00 0.00 H HETATM 37 H UNL 1 2.777 1.430 1.543 1.00 0.00 H HETATM 38 H UNL 1 2.448 1.997 -0.087 1.00 0.00 H HETATM 39 H UNL 1 6.520 1.600 -2.365 1.00 0.00 H HETATM 40 H UNL 1 6.084 -0.125 -2.178 1.00 0.00 H HETATM 41 H UNL 1 6.807 0.757 -0.831 1.00 0.00 H HETATM 42 H UNL 1 4.429 -2.484 0.299 1.00 0.00 H HETATM 43 H UNL 1 6.262 -5.023 0.886 1.00 0.00 H HETATM 44 H UNL 1 6.090 -4.954 4.469 1.00 0.00 H HETATM 45 H UNL 1 8.458 -4.438 3.846 1.00 0.00 H HETATM 46 H UNL 1 3.753 -4.221 3.814 1.00 0.00 H HETATM 47 H UNL 1 1.878 -5.088 4.277 1.00 0.00 H HETATM 48 H UNL 1 2.906 -7.090 3.175 1.00 0.00 H HETATM 49 H UNL 1 0.327 -6.316 -0.061 1.00 0.00 H HETATM 50 H UNL 1 3.354 -4.978 -0.888 1.00 0.00 H HETATM 51 H UNL 1 2.594 -6.220 -1.899 1.00 0.00 H HETATM 52 H UNL 1 4.367 -6.146 -1.719 1.00 0.00 H CONECT 1 2 6 33 CONECT 2 1 3 34 CONECT 3 2 4 8 CONECT 4 3 5 7 CONECT 5 4 6 9 CONECT 6 5 1 35 CONECT 7 4 36 37 38 CONECT 8 3 39 40 41 CONECT 9 5 10 42 CONECT 10 9 11 12 CONECT 11 10 CONECT 12 10 13 17 CONECT 13 12 14 43 CONECT 14 13 15 19 CONECT 15 14 16 44 CONECT 16 15 17 45 CONECT 17 16 12 18 CONECT 18 17 CONECT 19 14 20 46 CONECT 20 19 21 22 CONECT 21 20 23 27 CONECT 22 20 CONECT 23 21 24 47 CONECT 24 23 25 48 CONECT 25 24 26 29 CONECT 26 25 27 49 CONECT 27 26 21 28 CONECT 28 27 CONECT 29 25 30 31 32 CONECT 30 29 50 51 52 CONECT 31 29 CONECT 32 29 CONECT 33 1 CONECT 34 2 CONECT 35 6 CONECT 36 7 CONECT 37 7 CONECT 38 7 CONECT 39 8 CONECT 40 8 CONECT 41 8 CONECT 42 9 CONECT 43 13 CONECT 44 15 CONECT 45 16 CONECT 46 19 CONECT 47 23 CONECT 48 24 CONECT 49 26 CONECT 50 30 CONECT 51 30 CONECT 52 30 MASTER 0 0 0 0 0 0 0 0 52 0 52 0 END M END $$$$