D0JR2C AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 5.910 5.725 4.215 1.00 0.00 C HETATM 2 C UNL 1 6.052 5.158 2.957 1.00 0.00 C HETATM 3 C UNL 1 5.481 3.890 2.709 1.00 0.00 C HETATM 4 C UNL 1 5.274 3.029 3.770 1.00 0.00 C HETATM 5 C UNL 1 5.166 3.566 5.045 1.00 0.00 C HETATM 6 C UNL 1 5.378 4.943 5.242 1.00 0.00 C HETATM 7 C UNL 1 5.912 5.930 1.769 1.00 0.00 C HETATM 8 N UNL 1 4.896 5.385 1.011 1.00 0.00 N HETATM 9 C UNL 1 4.396 4.139 1.605 1.00 0.00 C HETATM 10 C UNL 1 6.181 7.153 1.228 1.00 0.00 C HETATM 11 N UNL 1 5.191 7.458 0.323 1.00 0.00 N HETATM 12 C UNL 1 4.345 6.438 0.361 1.00 0.00 C HETATM 13 C UNL 1 4.009 3.011 0.630 1.00 0.00 C HETATM 14 C UNL 1 2.763 3.453 -0.187 1.00 0.00 C HETATM 15 C UNL 1 2.252 2.563 -1.340 1.00 0.00 C HETATM 16 O UNL 1 1.693 3.729 0.713 1.00 0.00 O HETATM 17 C UNL 1 1.772 1.163 -0.935 1.00 0.00 C HETATM 18 C UNL 1 1.194 0.417 -2.135 1.00 0.00 C HETATM 19 C UNL 1 2.210 0.327 -3.282 1.00 0.00 C HETATM 20 C UNL 1 2.783 1.688 -3.674 1.00 0.00 C HETATM 21 C UNL 1 3.277 2.503 -2.483 1.00 0.00 C HETATM 22 H UNL 1 1.358 3.081 -1.728 1.00 0.00 H HETATM 23 O UNL 1 1.592 -0.264 -4.421 1.00 0.00 O HETATM 24 F UNL 1 5.053 1.726 3.566 1.00 0.00 F HETATM 25 H UNL 1 5.977 6.805 4.335 1.00 0.00 H HETATM 26 H UNL 1 4.834 2.945 5.866 1.00 0.00 H HETATM 27 H UNL 1 5.068 5.414 6.170 1.00 0.00 H HETATM 28 H UNL 1 3.504 4.443 2.171 1.00 0.00 H HETATM 29 H UNL 1 6.928 7.878 1.530 1.00 0.00 H HETATM 30 H UNL 1 3.327 6.457 0.000 1.00 0.00 H HETATM 31 H UNL 1 3.763 2.114 1.207 1.00 0.00 H HETATM 32 H UNL 1 4.843 2.769 -0.028 1.00 0.00 H HETATM 33 H UNL 1 2.994 4.419 -0.662 1.00 0.00 H HETATM 34 H UNL 1 1.438 2.912 1.173 1.00 0.00 H HETATM 35 H UNL 1 1.000 1.232 -0.168 1.00 0.00 H HETATM 36 H UNL 1 2.609 0.592 -0.509 1.00 0.00 H HETATM 37 H UNL 1 0.292 0.939 -2.500 1.00 0.00 H HETATM 38 H UNL 1 0.882 -0.571 -1.842 1.00 0.00 H HETATM 39 H UNL 1 3.025 -0.337 -2.977 1.00 0.00 H HETATM 40 H UNL 1 2.028 2.262 -4.227 1.00 0.00 H HETATM 41 H UNL 1 3.613 1.543 -4.375 1.00 0.00 H HETATM 42 H UNL 1 4.220 2.087 -2.126 1.00 0.00 H HETATM 43 H UNL 1 3.482 3.527 -2.833 1.00 0.00 H HETATM 44 H UNL 1 0.944 0.368 -4.778 1.00 0.00 H CONECT 1 2 6 25 CONECT 2 1 3 7 CONECT 3 2 4 9 CONECT 4 3 5 24 CONECT 5 4 6 26 CONECT 6 5 1 27 CONECT 7 2 8 10 CONECT 8 7 9 12 CONECT 9 8 3 13 28 CONECT 10 7 11 29 CONECT 11 10 12 CONECT 12 11 8 30 CONECT 13 9 14 31 32 CONECT 14 13 16 15 33 CONECT 15 17 21 22 14 CONECT 16 14 34 CONECT 17 15 18 35 36 CONECT 18 17 19 37 38 CONECT 19 18 20 23 39 CONECT 20 19 21 40 41 CONECT 21 20 15 42 43 CONECT 22 15 CONECT 23 19 44 CONECT 24 4 CONECT 25 1 CONECT 26 5 CONECT 27 6 CONECT 28 9 CONECT 29 10 CONECT 30 12 CONECT 31 13 CONECT 32 13 CONECT 33 14 CONECT 34 16 CONECT 35 17 CONECT 36 17 CONECT 37 18 CONECT 38 18 CONECT 39 19 CONECT 40 20 CONECT 41 20 CONECT 42 21 CONECT 43 21 CONECT 44 23 MASTER 0 0 0 0 0 0 0 0 44 0 44 0 END M END $$$$