D01GWS AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 1.014 0.156 -0.522 1.00 0.00 C HETATM 2 C UNL 1 1.673 -0.976 -0.263 1.00 0.00 C HETATM 3 C UNL 1 1.230 -2.216 -0.961 1.00 0.00 C HETATM 4 N UNL 1 0.617 -1.948 -2.210 1.00 0.00 N HETATM 5 C UNL 1 0.620 -0.622 -2.680 1.00 0.00 C HETATM 6 C UNL 1 0.159 0.231 -1.709 1.00 0.00 C HETATM 7 C UNL 1 1.324 1.248 0.424 1.00 0.00 C HETATM 8 C UNL 1 2.530 0.680 1.189 1.00 0.00 C HETATM 9 C UNL 1 2.795 -0.748 0.675 1.00 0.00 C HETATM 10 C UNL 1 -1.325 0.184 -1.369 1.00 0.00 C HETATM 11 N UNL 1 -2.177 0.092 -2.448 1.00 0.00 N HETATM 12 O UNL 1 -1.717 0.276 -0.207 1.00 0.00 O HETATM 13 O UNL 1 -3.541 -0.180 -2.139 1.00 0.00 O HETATM 14 C UNL 1 -4.214 1.079 -1.984 1.00 0.00 C HETATM 15 C UNL 1 -5.718 0.905 -1.730 1.00 0.00 C HETATM 16 C UNL 1 -6.006 0.097 -0.459 1.00 0.00 C HETATM 17 C UNL 1 -6.361 2.286 -1.642 1.00 0.00 C HETATM 18 O UNL 1 -6.314 0.216 -2.834 1.00 0.00 O HETATM 19 N UNL 1 1.765 -0.405 -3.509 1.00 0.00 N HETATM 20 C UNL 1 2.864 0.467 -3.221 1.00 0.00 C HETATM 21 O UNL 1 1.345 -3.328 -0.462 1.00 0.00 O HETATM 22 C UNL 1 -0.389 -2.864 -2.723 1.00 0.00 C HETATM 23 C UNL 1 4.186 -0.006 -3.364 1.00 0.00 C HETATM 24 C UNL 1 5.266 0.690 -2.799 1.00 0.00 C HETATM 25 C UNL 1 5.028 1.877 -2.120 1.00 0.00 C HETATM 26 C UNL 1 3.768 2.473 -2.180 1.00 0.00 C HETATM 27 C UNL 1 2.712 1.775 -2.773 1.00 0.00 C HETATM 28 F UNL 1 1.519 2.389 -2.842 1.00 0.00 F HETATM 29 I UNL 1 6.505 2.712 -0.920 1.00 0.00 I HETATM 30 H UNL 1 1.552 2.195 -0.067 1.00 0.00 H HETATM 31 H UNL 1 0.486 1.414 1.114 1.00 0.00 H HETATM 32 H UNL 1 2.330 0.669 2.267 1.00 0.00 H HETATM 33 H UNL 1 3.407 1.321 1.036 1.00 0.00 H HETATM 34 H UNL 1 3.725 -0.753 0.094 1.00 0.00 H HETATM 35 H UNL 1 2.879 -1.478 1.480 1.00 0.00 H HETATM 36 H UNL 1 -1.864 -0.176 -3.373 1.00 0.00 H HETATM 37 H UNL 1 -4.058 1.649 -2.912 1.00 0.00 H HETATM 38 H UNL 1 -3.758 1.635 -1.154 1.00 0.00 H HETATM 39 H UNL 1 -5.562 0.569 0.425 1.00 0.00 H HETATM 40 H UNL 1 -5.627 -0.925 -0.538 1.00 0.00 H HETATM 41 H UNL 1 -7.086 0.017 -0.302 1.00 0.00 H HETATM 42 H UNL 1 -5.951 2.868 -0.809 1.00 0.00 H HETATM 43 H UNL 1 -7.451 2.218 -1.523 1.00 0.00 H HETATM 44 H UNL 1 -6.186 2.849 -2.566 1.00 0.00 H HETATM 45 H UNL 1 -5.911 -0.671 -2.860 1.00 0.00 H HETATM 46 H UNL 1 2.149 -1.335 -3.687 1.00 0.00 H HETATM 47 H UNL 1 0.103 -3.743 -3.142 1.00 0.00 H HETATM 48 H UNL 1 -0.986 -2.379 -3.503 1.00 0.00 H HETATM 49 H UNL 1 -1.056 -3.171 -1.910 1.00 0.00 H HETATM 50 H UNL 1 4.396 -0.952 -3.858 1.00 0.00 H HETATM 51 H UNL 1 6.268 0.270 -2.851 1.00 0.00 H HETATM 52 H UNL 1 3.576 3.437 -1.737 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 9 CONECT 3 2 4 21 CONECT 4 3 5 22 CONECT 5 4 6 19 CONECT 6 5 1 10 CONECT 7 1 8 30 31 CONECT 8 7 9 32 33 CONECT 9 8 2 34 35 CONECT 10 6 11 12 CONECT 11 10 13 36 CONECT 12 10 CONECT 13 11 14 CONECT 14 13 15 37 38 CONECT 15 14 16 17 18 CONECT 16 15 39 40 41 CONECT 17 15 42 43 44 CONECT 18 15 45 CONECT 19 5 20 46 CONECT 20 19 23 27 CONECT 21 3 CONECT 22 4 47 48 49 CONECT 23 20 24 50 CONECT 24 23 25 51 CONECT 25 24 26 29 CONECT 26 25 27 52 CONECT 27 26 20 28 CONECT 28 27 CONECT 29 25 CONECT 30 7 CONECT 31 7 CONECT 32 8 CONECT 33 8 CONECT 34 9 CONECT 35 9 CONECT 36 11 CONECT 37 14 CONECT 38 14 CONECT 39 16 CONECT 40 16 CONECT 41 16 CONECT 42 17 CONECT 43 17 CONECT 44 17 CONECT 45 18 CONECT 46 19 CONECT 47 22 CONECT 48 22 CONECT 49 22 CONECT 50 23 CONECT 51 24 CONECT 52 26 MASTER 0 0 0 0 0 0 0 0 52 0 52 0 END M END $$$$