COMPND UNNAMED AUTHOR GENERATED BY OPEN BABEL 3.0.0 HETATM 1 C UNL 1 -7.866 0.861 -0.442 1.00 0.00 C HETATM 2 C UNL 1 0.358 -1.911 0.443 1.00 0.00 C HETATM 3 C UNL 1 0.181 0.616 0.513 1.00 0.00 C HETATM 4 C UNL 1 2.519 1.033 -0.239 1.00 0.00 C HETATM 5 C UNL 1 3.863 1.230 0.045 1.00 0.00 C HETATM 6 C UNL 1 4.304 1.221 1.362 1.00 0.00 C HETATM 7 C UNL 1 2.068 0.819 2.128 1.00 0.00 C HETATM 8 C UNL 1 -4.135 -1.147 -0.068 1.00 0.00 C HETATM 9 C UNL 1 -4.074 -2.541 -0.112 1.00 0.00 C HETATM 10 N UNL 1 -2.931 -3.180 0.002 1.00 0.00 N HETATM 11 C UNL 1 -2.956 -0.422 0.100 1.00 0.00 C HETATM 12 N UNL 1 -0.481 -2.966 0.304 1.00 0.00 N HETATM 13 C UNL 1 -0.353 -0.747 0.400 1.00 0.00 C HETATM 14 C UNL 1 -1.765 -1.131 0.217 1.00 0.00 C HETATM 15 C UNL 1 -1.782 -2.536 0.163 1.00 0.00 C HETATM 16 C UNL 1 -5.437 -0.446 -0.199 1.00 0.00 C HETATM 17 C UNL 1 1.612 0.826 0.805 1.00 0.00 C HETATM 18 C UNL 1 3.409 1.017 2.396 1.00 0.00 C HETATM 19 F UNL 1 1.198 0.620 3.142 1.00 0.00 F HETATM 20 F UNL 1 2.088 1.046 -1.520 1.00 0.00 F HETATM 21 N UNL 1 4.776 1.437 -0.997 1.00 0.00 N HETATM 22 S UNL 1 6.312 0.830 -0.885 1.00 0.00 S HETATM 23 O UNL 1 6.906 1.146 -2.136 1.00 0.00 O HETATM 24 O UNL 1 6.818 1.377 0.325 1.00 0.00 O HETATM 25 C UNL 1 6.081 -0.962 -0.725 1.00 0.00 C HETATM 26 C UNL 1 7.445 -1.645 -0.612 1.00 0.00 C HETATM 27 C UNL 1 7.249 -3.157 -0.477 1.00 0.00 C HETATM 28 C UNL 1 -6.611 -1.178 -0.367 1.00 0.00 C HETATM 29 C UNL 1 -7.819 -0.522 -0.488 1.00 0.00 C HETATM 30 C UNL 1 -6.702 1.592 -0.275 1.00 0.00 C HETATM 31 C UNL 1 -5.490 0.945 -0.153 1.00 0.00 C HETATM 32 CL UNL 1 -9.388 1.681 -0.602 1.00 0.00 Cl HETATM 33 H UNL 1 1.428 -1.981 0.573 1.00 0.00 H HETATM 34 H UNL 1 5.351 1.374 1.579 1.00 0.00 H HETATM 35 H UNL 1 -4.985 -3.106 -0.242 1.00 0.00 H HETATM 36 H UNL 1 -2.966 0.658 0.138 1.00 0.00 H HETATM 37 H UNL 1 3.760 1.011 3.418 1.00 0.00 H HETATM 38 H UNL 1 4.508 1.936 -1.784 1.00 0.00 H HETATM 39 H UNL 1 5.493 -1.174 0.169 1.00 0.00 H HETATM 40 H UNL 1 5.556 -1.341 -1.602 1.00 0.00 H HETATM 41 H UNL 1 8.032 -1.433 -1.505 1.00 0.00 H HETATM 42 H UNL 1 7.969 -1.267 0.266 1.00 0.00 H HETATM 43 H UNL 1 6.662 -3.369 0.417 1.00 0.00 H HETATM 44 H UNL 1 6.725 -3.535 -1.354 1.00 0.00 H HETATM 45 H UNL 1 8.222 -3.643 -0.396 1.00 0.00 H HETATM 46 H UNL 1 -6.575 -2.257 -0.403 1.00 0.00 H HETATM 47 H UNL 1 -8.729 -1.088 -0.619 1.00 0.00 H HETATM 48 H UNL 1 -6.744 2.671 -0.239 1.00 0.00 H HETATM 49 H UNL 1 -4.582 1.517 -0.023 1.00 0.00 H HETATM 50 O UNL 1 -0.557 1.573 0.366 1.00 0.00 O HETATM 51 H UNL 1 -0.204 -3.896 0.303 1.00 0.00 H CONECT 1 29 29 30 32 CONECT 2 12 13 13 33 CONECT 3 13 17 50 50 CONECT 4 5 5 17 20 CONECT 5 4 4 6 21 CONECT 6 5 18 18 34 CONECT 7 17 17 18 19 CONECT 8 9 9 11 16 CONECT 9 8 8 10 35 CONECT 10 9 15 15 CONECT 11 8 14 14 36 CONECT 12 2 15 51 CONECT 13 2 2 3 14 CONECT 14 11 11 13 15 CONECT 15 10 10 12 14 CONECT 16 8 28 28 31 CONECT 17 3 4 7 7 CONECT 18 6 6 7 37 CONECT 19 7 CONECT 20 4 CONECT 21 5 22 38 CONECT 22 21 23 23 24 CONECT 22 24 25 CONECT 23 22 22 CONECT 24 22 22 CONECT 25 22 26 39 40 CONECT 26 25 27 41 42 CONECT 27 26 43 44 45 CONECT 28 16 16 29 46 CONECT 29 1 1 28 47 CONECT 30 1 31 31 48 CONECT 31 16 30 30 49 CONECT 32 1 CONECT 33 2 CONECT 34 6 CONECT 35 9 CONECT 36 11 CONECT 37 18 CONECT 38 21 CONECT 39 25 CONECT 40 25 CONECT 41 26 CONECT 42 26 CONECT 43 27 CONECT 44 27 CONECT 45 27 CONECT 46 28 CONECT 47 29 CONECT 48 30 CONECT 49 31 CONECT 50 3 3 CONECT 51 12 MASTER 0 0 0 0 0 0 0 0 51 0 51 0 END