D05GEL AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 N UNL 1 -1.643 -1.357 5.696 1.00 0.00 N HETATM 2 C UNL 1 -2.295 0.567 2.796 1.00 0.00 C HETATM 3 C UNL 1 -1.791 0.363 4.072 1.00 0.00 C HETATM 4 C UNL 1 -2.467 -0.532 4.982 1.00 0.00 C HETATM 5 N UNL 1 -1.143 0.620 2.081 1.00 0.00 N HETATM 6 N UNL 1 -0.145 1.195 2.778 1.00 0.00 N HETATM 7 C UNL 1 -0.524 1.036 4.057 1.00 0.00 C HETATM 8 N UNL 1 0.177 1.420 5.166 1.00 0.00 N HETATM 9 C UNL 1 1.285 2.316 5.270 1.00 0.00 C HETATM 10 C UNL 1 2.122 2.652 4.194 1.00 0.00 C HETATM 11 C UNL 1 3.171 3.577 4.331 1.00 0.00 C HETATM 12 C UNL 1 3.399 4.188 5.560 1.00 0.00 C HETATM 13 C UNL 1 2.627 3.832 6.667 1.00 0.00 C HETATM 14 C UNL 1 1.586 2.898 6.517 1.00 0.00 C HETATM 15 O UNL 1 -3.673 -0.755 4.942 1.00 0.00 O HETATM 16 S UNL 1 4.739 5.349 5.743 1.00 0.00 S HETATM 17 O UNL 1 5.738 5.017 4.745 1.00 0.00 O HETATM 18 C UNL 1 4.035 6.920 5.306 1.00 0.00 C HETATM 19 O UNL 1 5.087 5.397 7.150 1.00 0.00 O HETATM 20 C UNL 1 -0.827 -0.241 0.942 1.00 0.00 C HETATM 21 C UNL 1 -0.958 0.504 -0.383 1.00 0.00 C HETATM 22 C UNL 1 -2.331 0.900 -0.681 1.00 0.00 C HETATM 23 N UNL 1 -3.423 1.210 -0.930 1.00 0.00 N HETATM 24 C UNL 1 -1.522 -1.611 0.934 1.00 0.00 C HETATM 25 C UNL 1 -2.050 -2.627 1.959 1.00 0.00 C HETATM 26 C UNL 1 -0.629 -2.676 1.570 1.00 0.00 C HETATM 27 H UNL 1 -0.661 -1.410 5.456 1.00 0.00 H HETATM 28 H UNL 1 -2.084 -2.237 5.942 1.00 0.00 H HETATM 29 H UNL 1 -3.232 0.266 2.347 1.00 0.00 H HETATM 30 H UNL 1 -0.329 1.378 6.045 1.00 0.00 H HETATM 31 H UNL 1 1.985 2.191 3.221 1.00 0.00 H HETATM 32 H UNL 1 3.803 3.798 3.470 1.00 0.00 H HETATM 33 H UNL 1 2.827 4.264 7.645 1.00 0.00 H HETATM 34 H UNL 1 1.006 2.640 7.401 1.00 0.00 H HETATM 35 H UNL 1 3.627 6.869 4.296 1.00 0.00 H HETATM 36 H UNL 1 4.835 7.666 5.341 1.00 0.00 H HETATM 37 H UNL 1 3.261 7.183 6.029 1.00 0.00 H HETATM 38 H UNL 1 0.249 -0.446 1.051 1.00 0.00 H HETATM 39 H UNL 1 -0.302 1.382 -0.386 1.00 0.00 H HETATM 40 H UNL 1 -0.586 -0.151 -1.200 1.00 0.00 H HETATM 41 H UNL 1 -2.158 -1.714 0.061 1.00 0.00 H HETATM 42 H UNL 1 -2.651 -3.458 1.582 1.00 0.00 H HETATM 43 H UNL 1 -2.353 -2.337 2.950 1.00 0.00 H HETATM 44 H UNL 1 -0.248 -3.458 0.929 1.00 0.00 H HETATM 45 H UNL 1 0.061 -2.396 2.365 1.00 0.00 H CONECT 1 4 27 28 CONECT 2 3 5 29 CONECT 3 2 4 7 CONECT 4 3 1 15 CONECT 5 2 6 20 CONECT 6 5 7 CONECT 7 6 3 8 CONECT 8 7 9 30 CONECT 9 8 10 14 CONECT 10 9 11 31 CONECT 11 10 12 32 CONECT 12 11 13 16 CONECT 13 12 14 33 CONECT 14 13 9 34 CONECT 15 4 CONECT 16 12 17 18 19 CONECT 17 16 CONECT 18 16 35 36 37 CONECT 19 16 CONECT 20 24 21 5 38 CONECT 21 22 20 39 40 CONECT 22 21 23 CONECT 23 22 CONECT 24 20 25 26 41 CONECT 25 24 26 42 43 CONECT 26 25 24 44 45 CONECT 27 1 CONECT 28 1 CONECT 29 2 CONECT 30 8 CONECT 31 10 CONECT 32 11 CONECT 33 13 CONECT 34 14 CONECT 35 18 CONECT 36 18 CONECT 37 18 CONECT 38 20 CONECT 39 21 CONECT 40 21 CONECT 41 24 CONECT 42 25 CONECT 43 25 CONECT 44 26 CONECT 45 26 MASTER 0 0 0 0 0 0 0 0 45 0 45 0 END M END $$$$