D0O0YI AUTHOR GENERATED BY OPEN BABEL 2.4.1 HETATM 1 C UNL 1 4.663 2.693 -2.071 1.00 0.00 C HETATM 2 C UNL 1 3.668 3.109 -2.984 1.00 0.00 C HETATM 3 C UNL 1 4.066 3.486 -4.294 1.00 0.00 C HETATM 4 N UNL 1 5.311 3.242 -4.767 1.00 0.00 N HETATM 5 C UNL 1 6.177 2.705 -3.902 1.00 0.00 C HETATM 6 C UNL 1 5.968 2.695 -2.536 1.00 0.00 C HETATM 7 O UNL 1 4.520 2.707 -0.685 1.00 0.00 O HETATM 8 C UNL 1 3.212 4.141 -5.368 1.00 0.00 C HETATM 9 N UNL 1 3.916 4.447 -6.519 1.00 0.00 N HETATM 10 O UNL 1 2.020 4.422 -5.168 1.00 0.00 O HETATM 11 C UNL 1 3.390 4.990 -7.730 1.00 0.00 C HETATM 12 C UNL 1 4.085 1.497 0.015 1.00 0.00 C HETATM 13 C UNL 1 2.879 1.813 0.640 1.00 0.00 C HETATM 14 C UNL 1 2.906 2.417 1.929 1.00 0.00 C HETATM 15 C UNL 1 4.126 2.598 2.608 1.00 0.00 C HETATM 16 C UNL 1 4.931 1.504 2.311 1.00 0.00 C HETATM 17 C UNL 1 5.004 1.025 0.974 1.00 0.00 C HETATM 18 N UNL 1 4.843 3.815 2.249 1.00 0.00 N HETATM 19 F UNL 1 5.276 0.686 3.315 1.00 0.00 F HETATM 20 C UNL 1 4.779 5.016 2.905 1.00 0.00 C HETATM 21 N UNL 1 5.519 5.190 4.135 1.00 0.00 N HETATM 22 O UNL 1 4.284 5.970 2.347 1.00 0.00 O HETATM 23 C UNL 1 5.312 6.397 4.888 1.00 0.00 C HETATM 24 C UNL 1 4.075 6.978 4.884 1.00 0.00 C HETATM 25 C UNL 1 4.064 7.966 5.863 1.00 0.00 C HETATM 26 N UNL 1 5.296 8.151 6.385 1.00 0.00 N HETATM 27 N UNL 1 6.098 7.224 5.761 1.00 0.00 N HETATM 28 C UNL 1 2.787 8.603 6.388 1.00 0.00 C HETATM 29 C UNL 1 2.267 7.746 7.564 1.00 0.00 C HETATM 30 C UNL 1 3.004 10.066 6.780 1.00 0.00 C HETATM 31 C UNL 1 1.655 8.591 5.318 1.00 0.00 C HETATM 32 C UNL 1 7.522 7.146 5.986 1.00 0.00 C HETATM 33 C UNL 1 8.418 8.042 6.649 1.00 0.00 C HETATM 34 C UNL 1 9.873 7.772 6.562 1.00 0.00 C HETATM 35 C UNL 1 10.234 6.495 6.093 1.00 0.00 C HETATM 36 C UNL 1 9.293 5.561 5.816 1.00 0.00 C HETATM 37 C UNL 1 8.102 6.071 5.352 1.00 0.00 C HETATM 38 C UNL 1 11.019 8.621 6.787 1.00 0.00 C HETATM 39 C UNL 1 12.296 8.249 6.346 1.00 0.00 C HETATM 40 C UNL 1 12.428 7.016 5.736 1.00 0.00 C HETATM 41 N UNL 1 11.450 6.100 5.703 1.00 0.00 N HETATM 42 H UNL 1 2.637 3.222 -2.667 1.00 0.00 H HETATM 43 H UNL 1 6.809 1.954 -4.370 1.00 0.00 H HETATM 44 H UNL 1 6.731 3.159 -1.906 1.00 0.00 H HETATM 45 H UNL 1 4.900 4.166 -6.496 1.00 0.00 H HETATM 46 H UNL 1 2.391 5.416 -7.636 1.00 0.00 H HETATM 47 H UNL 1 3.390 4.220 -8.515 1.00 0.00 H HETATM 48 H UNL 1 4.075 5.789 -8.085 1.00 0.00 H HETATM 49 H UNL 1 1.962 1.353 0.272 1.00 0.00 H HETATM 50 H UNL 1 1.971 2.430 2.493 1.00 0.00 H HETATM 51 H UNL 1 5.414 0.015 0.869 1.00 0.00 H HETATM 52 H UNL 1 4.489 4.089 1.326 1.00 0.00 H HETATM 53 H UNL 1 6.206 4.515 4.445 1.00 0.00 H HETATM 54 H UNL 1 3.217 6.633 4.324 1.00 0.00 H HETATM 55 H UNL 1 3.035 7.579 8.326 1.00 0.00 H HETATM 56 H UNL 1 1.953 6.753 7.208 1.00 0.00 H HETATM 57 H UNL 1 1.394 8.203 8.042 1.00 0.00 H HETATM 58 H UNL 1 3.876 10.201 7.426 1.00 0.00 H HETATM 59 H UNL 1 2.128 10.468 7.299 1.00 0.00 H HETATM 60 H UNL 1 3.163 10.678 5.882 1.00 0.00 H HETATM 61 H UNL 1 1.383 7.573 5.008 1.00 0.00 H HETATM 62 H UNL 1 1.945 9.140 4.415 1.00 0.00 H HETATM 63 H UNL 1 0.739 9.045 5.712 1.00 0.00 H HETATM 64 H UNL 1 8.065 8.972 7.099 1.00 0.00 H HETATM 65 H UNL 1 9.610 4.578 5.514 1.00 0.00 H HETATM 66 H UNL 1 8.121 6.204 4.256 1.00 0.00 H HETATM 67 H UNL 1 10.909 9.602 7.231 1.00 0.00 H HETATM 68 H UNL 1 13.179 8.879 6.420 1.00 0.00 H HETATM 69 H UNL 1 13.326 6.695 5.197 1.00 0.00 H CONECT 1 2 6 7 CONECT 2 1 3 42 CONECT 3 2 4 8 CONECT 4 3 5 CONECT 5 4 6 43 CONECT 6 5 1 44 CONECT 7 1 12 CONECT 8 3 9 10 CONECT 9 8 11 45 CONECT 10 8 CONECT 11 9 46 47 48 CONECT 12 7 13 17 CONECT 13 12 14 49 CONECT 14 13 15 50 CONECT 15 14 16 18 CONECT 16 15 17 19 CONECT 17 16 12 51 CONECT 18 15 20 52 CONECT 19 16 CONECT 20 18 21 22 CONECT 21 20 23 53 CONECT 22 20 CONECT 23 21 24 27 CONECT 24 23 25 54 CONECT 25 24 26 28 CONECT 26 25 27 CONECT 27 26 23 32 CONECT 28 25 29 30 31 CONECT 29 28 55 56 57 CONECT 30 28 58 59 60 CONECT 31 28 61 62 63 CONECT 32 27 33 37 CONECT 33 32 34 64 CONECT 34 33 35 38 CONECT 35 34 36 41 CONECT 36 35 37 65 CONECT 37 36 32 66 CONECT 38 34 39 67 CONECT 39 38 40 68 CONECT 40 39 41 69 CONECT 41 40 35 CONECT 42 2 CONECT 43 5 CONECT 44 6 CONECT 45 9 CONECT 46 11 CONECT 47 11 CONECT 48 11 CONECT 49 13 CONECT 50 14 CONECT 51 17 CONECT 52 18 CONECT 53 21 CONECT 54 24 CONECT 55 29 CONECT 56 29 CONECT 57 29 CONECT 58 30 CONECT 59 30 CONECT 60 30 CONECT 61 31 CONECT 62 31 CONECT 63 31 CONECT 64 33 CONECT 65 36 CONECT 66 37 CONECT 67 38 CONECT 68 39 CONECT 69 40 MASTER 0 0 0 0 0 0 0 0 69 0 69 0 END M END $$$$