D0WT9J AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 0.975 -0.064 -0.073 1.00 0.00 C HETATM 2 C UNL 1 6.736 -0.064 -0.073 1.00 0.00 C HETATM 3 C UNL 1 7.177 -0.917 -0.887 1.00 0.00 C HETATM 4 C UNL 1 5.671 -1.509 -0.477 1.00 0.00 C HETATM 5 C UNL 1 3.948 -1.025 -0.173 1.00 0.00 C HETATM 6 C UNL 1 2.415 -0.064 -0.073 1.00 0.00 C HETATM 7 N UNL 1 6.607 -0.382 -2.392 1.00 0.00 N HETATM 8 C UNL 1 6.534 -1.333 -3.499 1.00 0.00 C HETATM 9 C UNL 1 5.578 -0.877 -4.648 1.00 0.00 C HETATM 10 C UNL 1 5.582 0.640 -4.925 1.00 0.00 C HETATM 11 C UNL 1 5.280 1.351 -3.606 1.00 0.00 C HETATM 12 C UNL 1 6.376 1.060 -2.571 1.00 0.00 C HETATM 13 N UNL 1 6.507 0.144 1.364 1.00 0.00 N HETATM 14 C UNL 1 6.085 1.418 1.730 1.00 0.00 C HETATM 15 C UNL 1 6.375 1.869 3.114 1.00 0.00 C HETATM 16 O UNL 1 5.547 2.187 0.933 1.00 0.00 O HETATM 17 C UNL 1 6.111 3.177 3.491 1.00 0.00 C HETATM 18 S UNL 1 6.456 3.431 5.136 1.00 0.00 S HETATM 19 C UNL 1 6.944 1.787 5.274 1.00 0.00 C HETATM 20 N UNL 1 6.924 1.084 4.149 1.00 0.00 N HETATM 21 C UNL 1 7.312 1.248 6.555 1.00 0.00 C HETATM 22 N UNL 1 7.897 0.015 6.706 1.00 0.00 N HETATM 23 N UNL 1 8.142 -0.328 7.994 1.00 0.00 N HETATM 24 C UNL 1 7.687 0.745 8.704 1.00 0.00 C HETATM 25 C UNL 1 7.188 1.748 7.837 1.00 0.00 C HETATM 26 C UNL 1 4.582 1.097 -6.016 1.00 0.00 C HETATM 27 N UNL 1 4.902 0.556 -7.334 1.00 0.00 N HETATM 28 F UNL 1 5.820 -2.760 0.053 1.00 0.00 F HETATM 29 C UNL 1 7.695 0.798 10.217 1.00 0.00 C HETATM 30 F UNL 1 8.238 -0.304 10.810 1.00 0.00 F HETATM 31 F UNL 1 8.405 1.868 10.674 1.00 0.00 F HETATM 32 F UNL 1 6.440 0.930 10.716 1.00 0.00 F HETATM 33 H UNL 1 -0.057 -0.064 -0.073 1.00 0.00 H HETATM 34 H UNL 1 3.583 -1.980 0.312 1.00 0.00 H HETATM 35 H UNL 1 2.735 0.764 -0.765 1.00 0.00 H HETATM 36 H UNL 1 6.178 -2.313 -3.155 1.00 0.00 H HETATM 37 H UNL 1 7.539 -1.458 -3.900 1.00 0.00 H HETATM 38 H UNL 1 4.548 -1.184 -4.411 1.00 0.00 H HETATM 39 H UNL 1 5.847 -1.421 -5.561 1.00 0.00 H HETATM 40 H UNL 1 6.587 0.933 -5.254 1.00 0.00 H HETATM 41 H UNL 1 4.295 1.037 -3.230 1.00 0.00 H HETATM 42 H UNL 1 5.215 2.436 -3.764 1.00 0.00 H HETATM 43 H UNL 1 7.317 1.509 -2.894 1.00 0.00 H HETATM 44 H UNL 1 6.056 1.567 -1.657 1.00 0.00 H HETATM 45 H UNL 1 7.176 -0.291 1.990 1.00 0.00 H HETATM 46 H UNL 1 5.710 3.972 2.877 1.00 0.00 H HETATM 47 H UNL 1 8.149 -0.643 5.979 1.00 0.00 H HETATM 48 H UNL 1 6.766 2.699 8.138 1.00 0.00 H HETATM 49 H UNL 1 4.595 2.194 -6.092 1.00 0.00 H HETATM 50 H UNL 1 3.555 0.813 -5.757 1.00 0.00 H HETATM 51 H UNL 1 5.839 0.851 -7.607 1.00 0.00 H HETATM 52 H UNL 1 4.272 0.962 -8.027 1.00 0.00 H CONECT 1 2 6 33 CONECT 2 1 3 13 CONECT 3 2 4 7 CONECT 4 3 5 28 CONECT 5 4 6 34 CONECT 6 5 1 35 CONECT 7 3 8 12 CONECT 8 7 9 36 37 CONECT 9 8 10 38 39 CONECT 10 9 11 26 40 CONECT 11 10 12 41 42 CONECT 12 11 7 43 44 CONECT 13 2 14 45 CONECT 14 13 15 16 CONECT 15 14 17 20 CONECT 16 14 CONECT 17 15 18 46 CONECT 18 17 19 CONECT 19 18 20 21 CONECT 20 19 15 CONECT 21 19 22 25 CONECT 22 21 23 47 CONECT 23 22 24 CONECT 24 23 25 29 CONECT 25 24 21 48 CONECT 26 10 27 49 50 CONECT 27 26 51 52 CONECT 28 4 CONECT 29 24 30 31 32 CONECT 30 29 CONECT 31 29 CONECT 32 29 CONECT 33 1 CONECT 34 5 CONECT 35 6 CONECT 36 8 CONECT 37 8 CONECT 38 9 CONECT 39 9 CONECT 40 10 CONECT 41 11 CONECT 42 11 CONECT 43 12 CONECT 44 12 CONECT 45 13 CONECT 46 17 CONECT 47 22 CONECT 48 25 CONECT 49 26 CONECT 50 26 CONECT 51 27 CONECT 52 27 MASTER 0 0 0 0 0 0 0 0 52 0 52 0 END $$$$