D00PFS AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.612 1.490 1.417 1.00 0.00 C HETATM 2 N UNL 1 1.095 2.512 0.591 1.00 0.00 N HETATM 3 C UNL 1 -0.163 2.531 -0.146 1.00 0.00 C HETATM 4 C UNL 1 -0.730 3.972 -0.332 1.00 0.00 C HETATM 5 C UNL 1 0.289 5.162 -0.536 1.00 0.00 C HETATM 6 C UNL 1 1.556 4.864 0.301 1.00 0.00 C HETATM 7 C UNL 1 2.071 3.464 0.112 1.00 0.00 C HETATM 8 C UNL 1 -0.309 6.581 -0.126 1.00 0.00 C HETATM 9 C UNL 1 -1.170 7.911 -0.053 1.00 0.00 C HETATM 10 N UNL 1 -0.030 8.561 0.610 1.00 0.00 N HETATM 11 C UNL 1 0.499 7.258 1.009 1.00 0.00 C HETATM 12 C UNL 1 -0.162 9.492 1.639 1.00 0.00 C HETATM 13 C UNL 1 1.039 10.234 1.995 1.00 0.00 C HETATM 14 O UNL 1 -1.240 9.670 2.203 1.00 0.00 O HETATM 15 C UNL 1 1.201 0.095 1.248 1.00 0.00 C HETATM 16 O UNL 1 2.531 1.780 2.199 1.00 0.00 O HETATM 17 N UNL 1 -0.002 -0.377 0.983 1.00 0.00 N HETATM 18 C UNL 1 0.066 -1.764 0.871 1.00 0.00 C HETATM 19 C UNL 1 1.323 -2.317 0.967 1.00 0.00 C HETATM 20 S UNL 1 2.452 -1.103 1.366 1.00 0.00 S HETATM 21 S UNL 1 2.173 10.768 0.814 1.00 0.00 S HETATM 22 C UNL 1 2.149 12.296 1.573 1.00 0.00 C HETATM 23 C UNL 1 1.804 12.187 2.925 1.00 0.00 C HETATM 24 C UNL 1 1.348 10.846 3.194 1.00 0.00 C HETATM 25 C UNL 1 2.228 13.554 0.951 1.00 0.00 C HETATM 26 C UNL 1 1.137 14.253 1.435 1.00 0.00 C HETATM 27 C UNL 1 0.913 14.284 2.834 1.00 0.00 C HETATM 28 C UNL 1 1.582 13.360 3.650 1.00 0.00 C HETATM 29 CL UNL 1 0.715 10.396 4.732 1.00 0.00 Cl HETATM 30 C UNL 1 -0.016 14.410 0.470 1.00 0.00 C HETATM 31 F UNL 1 0.331 14.345 -0.838 1.00 0.00 F HETATM 32 F UNL 1 -0.924 13.371 0.637 1.00 0.00 F HETATM 33 F UNL 1 -0.734 15.545 0.635 1.00 0.00 F HETATM 34 H UNL 1 -0.906 1.908 0.360 1.00 0.00 H HETATM 35 H UNL 1 0.033 2.086 -1.129 1.00 0.00 H HETATM 36 H UNL 1 -1.355 4.180 0.548 1.00 0.00 H HETATM 37 H UNL 1 -1.416 3.964 -1.189 1.00 0.00 H HETATM 38 H UNL 1 0.577 5.186 -1.594 1.00 0.00 H HETATM 39 H UNL 1 1.343 4.989 1.368 1.00 0.00 H HETATM 40 H UNL 1 2.359 5.564 0.032 1.00 0.00 H HETATM 41 H UNL 1 3.033 3.357 0.621 1.00 0.00 H HETATM 42 H UNL 1 2.252 3.252 -0.950 1.00 0.00 H HETATM 43 H UNL 1 -1.277 6.075 -0.014 1.00 0.00 H HETATM 44 H UNL 1 -2.037 7.831 0.626 1.00 0.00 H HETATM 45 H UNL 1 -1.497 8.398 -0.973 1.00 0.00 H HETATM 46 H UNL 1 0.211 6.938 2.016 1.00 0.00 H HETATM 47 H UNL 1 1.583 7.302 0.911 1.00 0.00 H HETATM 48 H UNL 1 -0.838 -2.332 0.693 1.00 0.00 H HETATM 49 H UNL 1 1.626 -3.352 0.853 1.00 0.00 H HETATM 50 H UNL 1 2.467 13.582 -0.114 1.00 0.00 H HETATM 51 H UNL 1 0.049 14.792 3.252 1.00 0.00 H HETATM 52 H UNL 1 1.353 13.339 4.718 1.00 0.00 H CONECT 1 2 15 16 CONECT 2 1 3 7 CONECT 3 2 4 34 35 CONECT 4 3 5 36 37 CONECT 5 4 6 8 38 CONECT 6 5 7 39 40 CONECT 7 6 2 41 42 CONECT 8 5 9 11 43 CONECT 9 8 10 44 45 CONECT 10 9 11 12 CONECT 11 10 8 46 47 CONECT 12 10 13 14 CONECT 13 12 21 24 CONECT 14 12 CONECT 15 1 17 20 CONECT 16 1 CONECT 17 15 18 CONECT 18 17 19 48 CONECT 19 18 20 49 CONECT 20 19 15 CONECT 21 13 22 CONECT 22 21 23 25 CONECT 23 22 24 28 CONECT 24 23 13 29 CONECT 25 22 26 50 CONECT 26 30 25 27 CONECT 27 26 28 51 CONECT 28 27 23 52 CONECT 29 24 CONECT 30 31 32 33 26 CONECT 31 30 CONECT 32 30 CONECT 33 30 CONECT 34 3 CONECT 35 3 CONECT 36 4 CONECT 37 4 CONECT 38 5 CONECT 39 6 CONECT 40 6 CONECT 41 7 CONECT 42 7 CONECT 43 8 CONECT 44 9 CONECT 45 9 CONECT 46 11 CONECT 47 11 CONECT 48 18 CONECT 49 19 CONECT 50 25 CONECT 51 27 CONECT 52 28 MASTER 0 0 0 0 0 0 0 0 52 0 52 0 END M END $$$$