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multiple.pqr
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multiple.pqr
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MODEL 1
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 5.906 24.958 25.981 0.25860000 1.700 C
ATOM 2 C UNL A 1 4.704 24.156 26.762 0.18410000 1.700 C
ATOM 3 C UNL A 1 4.314 24.972 28.035 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.684 25.184 28.775 0.17950000 1.700 C
ATOM 5 C UNL A 1 6.736 26.015 27.889 0.18030000 1.700 C
ATOM 6 O UNL A 1 7.126 25.081 26.807 -0.32630000 1.520 O
ATOM 7 N UNL A 1 3.511 23.991 25.925 -0.19920000 1.550 N
ATOM 8 C UNL A 1 3.111 22.807 25.397 0.24200000 1.700 C
ATOM 9 O UNL A 1 3.738 21.850 25.507 -0.27330000 1.520 O
ATOM 10 C UNL A 1 1.804 22.859 24.677 0.09640000 1.700 C
ATOM 11 O UNL A 1 3.369 24.205 28.801 -0.21840000 1.520 O
ATOM 12 C UNL A 1 7.950 26.349 28.710 0.21410000 1.700 C
ATOM 13 O UNL A 1 8.250 25.133 29.556 -0.21760000 1.520 O
ATOM 14 O UNL A 1 5.574 25.911 30.035 -0.32640000 1.520 O
ATOM 15 C UNL A 1 4.577 26.696 30.744 0.25860000 1.700 C
ATOM 16 C UNL A 1 3.837 27.768 29.949 0.18420000 1.700 C
ATOM 17 C UNL A 1 3.014 28.606 30.874 0.20940000 1.700 C
ATOM 18 C UNL A 1 2.223 27.734 31.894 0.21360000 1.700 C
ATOM 19 C UNL A 1 3.030 26.579 32.522 0.18340000 1.700 C
ATOM 20 O UNL A 1 3.699 25.837 31.499 -0.32620000 1.520 O
ATOM 21 N UNL A 1 4.952 28.592 29.291 -0.19920000 1.550 N
ATOM 22 C UNL A 1 4.776 29.288 28.152 0.24200000 1.700 C
ATOM 23 O UNL A 1 3.892 29.078 27.444 -0.27330000 1.520 O
ATOM 24 C UNL A 1 5.800 30.343 27.909 0.09640000 1.700 C
ATOM 25 O UNL A 1 1.777 28.582 33.006 -0.21760000 1.520 O
ATOM 26 O UNL A 1 2.058 29.342 30.087 -0.21830000 1.520 O
ATOM 27 C UNL A 1 2.119 25.582 33.227 0.21420000 1.700 C
ATOM 28 O UNL A 1 0.751 25.624 32.720 -0.21760000 1.520 O
ATOM 29 O UNL A 1 6.264 24.206 24.762 -0.32640000 1.520 O
ATOM 30 C UNL A 1 8.627 24.360 21.367 0.29170000 1.700 C
ATOM 31 C UNL A 1 8.901 25.540 22.334 0.18700000 1.700 C
ATOM 32 C UNL A 1 8.242 25.265 23.670 0.20630000 1.700 C
ATOM 33 C UNL A 1 6.749 24.854 23.415 0.17950000 1.700 C
ATOM 34 C UNL A 1 6.480 23.886 22.254 0.18030000 1.700 C
ATOM 35 O UNL A 1 7.178 24.410 21.065 -0.32430000 1.520 O
ATOM 36 N UNL A 1 10.358 25.725 22.474 -0.19910000 1.550 N
ATOM 37 C UNL A 1 10.948 26.926 22.692 0.24200000 1.700 C
ATOM 38 O UNL A 1 10.329 27.888 22.741 -0.27330000 1.520 O
ATOM 39 C UNL A 1 12.423 26.848 22.857 0.09640000 1.700 C
ATOM 40 O UNL A 1 8.216 26.419 24.523 -0.21840000 1.520 O
ATOM 41 O UNL A 1 9.263 24.728 20.148 -0.18790000 1.520 O
ATOM 42 C UNL A 1 5.019 23.781 21.892 0.21410000 1.700 C
ATOM 43 O UNL A 1 4.127 24.603 22.780 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 2
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 3.370 27.163 29.037 0.25860000 1.700 C
ATOM 2 C UNL A 1 4.960 27.256 29.443 0.18410000 1.700 C
ATOM 3 C UNL A 1 5.803 26.662 28.271 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.165 25.244 28.037 0.17950000 1.700 C
ATOM 5 C UNL A 1 3.618 25.331 27.613 0.18030000 1.700 C
ATOM 6 O UNL A 1 2.922 25.768 28.847 -0.32630000 1.520 O
ATOM 7 N UNL A 1 5.392 28.637 29.680 -0.19920000 1.550 N
ATOM 8 C UNL A 1 5.814 29.106 30.881 0.24200000 1.700 C
ATOM 9 O UNL A 1 5.784 28.458 31.831 -0.27330000 1.520 O
ATOM 10 C UNL A 1 6.317 30.512 30.858 0.09640000 1.700 C
ATOM 11 O UNL A 1 7.180 26.603 28.679 -0.21840000 1.520 O
ATOM 12 C UNL A 1 3.114 23.970 27.222 0.21410000 1.700 C
ATOM 13 O UNL A 1 3.104 23.929 25.711 -0.21760000 1.520 O
ATOM 14 O UNL A 1 5.815 24.465 26.988 -0.32640000 1.520 O
ATOM 15 C UNL A 1 6.515 24.711 25.738 0.25860000 1.700 C
ATOM 16 C UNL A 1 7.954 24.214 25.635 0.18420000 1.700 C
ATOM 17 C UNL A 1 8.579 24.732 24.378 0.20940000 1.700 C
ATOM 18 C UNL A 1 7.630 24.574 23.154 0.21360000 1.700 C
ATOM 19 C UNL A 1 6.160 24.960 23.419 0.18340000 1.700 C
ATOM 20 O UNL A 1 5.696 24.328 24.615 -0.32620000 1.520 O
ATOM 21 N UNL A 1 8.645 24.786 26.880 -0.19920000 1.550 N
ATOM 22 C UNL A 1 9.895 24.445 27.247 0.24200000 1.700 C
ATOM 23 O UNL A 1 10.410 23.499 26.839 -0.27330000 1.520 O
ATOM 24 C UNL A 1 10.540 25.396 28.195 0.09640000 1.700 C
ATOM 25 O UNL A 1 8.099 25.443 22.068 -0.21760000 1.520 O
ATOM 26 O UNL A 1 9.770 23.964 24.117 -0.21830000 1.520 O
ATOM 27 C UNL A 1 5.245 24.463 22.308 0.21420000 1.700 C
ATOM 28 O UNL A 1 5.951 23.636 21.334 -0.21760000 1.520 O
ATOM 29 O UNL A 1 2.567 27.747 30.129 -0.32640000 1.520 O
ATOM 30 C UNL A 1 0.328 27.359 33.589 0.29170000 1.700 C
ATOM 31 C UNL A 1 1.721 26.691 33.706 0.18700000 1.700 C
ATOM 32 C UNL A 1 2.592 27.124 32.545 0.20630000 1.700 C
ATOM 33 C UNL A 1 1.787 26.919 31.214 0.17950000 1.700 C
ATOM 34 C UNL A 1 0.311 27.341 31.217 0.18030000 1.700 C
ATOM 35 O UNL A 1 -0.321 26.743 32.409 -0.32430000 1.520 O
ATOM 36 N UNL A 1 2.325 27.052 35.004 -0.19910000 1.550 N
ATOM 37 C UNL A 1 2.357 26.223 36.076 0.24200000 1.700 C
ATOM 38 O UNL A 1 1.869 25.187 36.037 -0.27330000 1.520 O
ATOM 39 C UNL A 1 3.071 26.790 37.250 0.09640000 1.700 C
ATOM 40 O UNL A 1 3.792 26.345 32.431 -0.21840000 1.520 O
ATOM 41 O UNL A 1 -0.411 26.870 34.703 -0.18790000 1.520 O
ATOM 42 C UNL A 1 -0.456 26.840 30.018 0.21410000 1.700 C
ATOM 43 O UNL A 1 0.141 25.603 29.407 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 3
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 3.570 27.338 28.524 0.25860000 1.700 C
ATOM 2 C UNL A 1 3.216 25.750 28.292 0.18410000 1.700 C
ATOM 3 C UNL A 1 4.527 25.008 27.884 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.066 25.847 26.668 0.17950000 1.700 C
ATOM 5 C UNL A 1 5.395 27.366 27.072 0.18030000 1.700 C
ATOM 6 O UNL A 1 4.067 27.986 27.293 -0.32630000 1.520 O
ATOM 7 N UNL A 1 2.674 25.119 29.500 -0.19920000 1.550 N
ATOM 8 C UNL A 1 3.323 25.074 30.691 0.24200000 1.700 C
ATOM 9 O UNL A 1 4.397 25.466 30.812 -0.27330000 1.520 O
ATOM 10 C UNL A 1 2.528 24.485 31.809 0.09640000 1.700 C
ATOM 11 O UNL A 1 4.199 23.652 27.535 -0.21840000 1.520 O
ATOM 12 C UNL A 1 6.079 28.066 25.929 0.21410000 1.700 C
ATOM 13 O UNL A 1 5.240 27.807 24.699 -0.21760000 1.520 O
ATOM 14 O UNL A 1 6.293 25.322 26.081 -0.32640000 1.520 O
ATOM 15 C UNL A 1 6.758 24.862 24.782 0.25860000 1.700 C
ATOM 16 C UNL A 1 5.697 24.423 23.777 0.18420000 1.700 C
ATOM 17 C UNL A 1 6.354 23.790 22.592 0.20940000 1.700 C
ATOM 18 C UNL A 1 7.575 24.622 22.096 0.21360000 1.700 C
ATOM 19 C UNL A 1 8.498 25.149 23.215 0.18340000 1.700 C
ATOM 20 O UNL A 1 7.719 25.785 24.232 -0.32620000 1.520 O
ATOM 21 N UNL A 1 4.839 23.409 24.547 -0.19920000 1.550 N
ATOM 22 C UNL A 1 3.590 23.072 24.174 0.24200000 1.700 C
ATOM 23 O UNL A 1 2.978 23.724 23.448 -0.27330000 1.520 O
ATOM 24 C UNL A 1 3.094 21.796 24.761 0.09640000 1.700 C
ATOM 25 O UNL A 1 8.409 23.781 21.231 -0.21760000 1.520 O
ATOM 26 O UNL A 1 5.393 23.732 21.520 -0.21830000 1.520 O
ATOM 27 C UNL A 1 9.449 26.218 22.694 0.21420000 1.700 C
ATOM 28 O UNL A 1 10.637 25.648 22.067 -0.21760000 1.520 O
ATOM 29 O UNL A 1 2.339 28.043 28.936 -0.32640000 1.520 O
ATOM 30 C UNL A 1 3.865 30.162 32.147 0.29170000 1.700 C
ATOM 31 C UNL A 1 2.636 29.302 32.535 0.18700000 1.700 C
ATOM 32 C UNL A 1 2.320 28.333 31.413 0.20630000 1.700 C
ATOM 33 C UNL A 1 2.262 29.133 30.065 0.17950000 1.700 C
ATOM 34 C UNL A 1 3.351 30.190 29.832 0.18030000 1.700 C
ATOM 35 O UNL A 1 3.416 31.036 31.039 -0.32430000 1.520 O
ATOM 36 N UNL A 1 2.917 28.596 33.800 -0.19910000 1.550 N
ATOM 37 C UNL A 1 1.964 28.269 34.708 0.24200000 1.700 C
ATOM 38 O UNL A 1 0.870 28.567 34.550 -0.27330000 1.520 O
ATOM 39 C UNL A 1 2.485 27.509 35.874 0.09640000 1.700 C
ATOM 40 O UNL A 1 1.044 27.696 31.575 -0.21840000 1.520 O
ATOM 41 O UNL A 1 4.059 31.045 33.247 -0.18790000 1.520 O
ATOM 42 C UNL A 1 3.054 31.107 28.671 0.21410000 1.700 C
ATOM 43 O UNL A 1 2.226 30.456 27.598 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 4
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 6.911 25.046 26.500 0.25860000 1.700 C
ATOM 2 C UNL A 1 5.393 24.418 26.550 0.18410000 1.700 C
ATOM 3 C UNL A 1 4.436 25.493 27.156 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.133 25.892 28.507 0.17950000 1.700 C
ATOM 5 C UNL A 1 6.593 26.520 28.281 0.18030000 1.700 C
ATOM 6 O UNL A 1 7.425 25.374 27.846 -0.32630000 1.520 O
ATOM 7 N UNL A 1 4.902 24.047 25.220 -0.19920000 1.550 N
ATOM 8 C UNL A 1 4.080 22.994 24.978 0.24200000 1.700 C
ATOM 9 O UNL A 1 3.773 22.261 25.810 -0.27330000 1.520 O
ATOM 10 C UNL A 1 3.616 22.879 23.564 0.09640000 1.700 C
ATOM 11 O UNL A 1 3.139 24.901 27.341 -0.21840000 1.520 O
ATOM 12 C UNL A 1 7.132 27.053 29.579 0.21410000 1.700 C
ATOM 13 O UNL A 1 6.643 26.123 30.666 -0.21760000 1.520 O
ATOM 14 O UNL A 1 4.397 26.881 29.287 -0.32640000 1.520 O
ATOM 15 C UNL A 1 3.280 26.909 30.218 0.25860000 1.700 C
ATOM 16 C UNL A 1 3.215 28.079 31.195 0.18420000 1.700 C
ATOM 17 C UNL A 1 2.137 27.837 32.202 0.20940000 1.700 C
ATOM 18 C UNL A 1 0.824 27.332 31.532 0.21360000 1.700 C
ATOM 19 C UNL A 1 1.025 26.256 30.445 0.18340000 1.700 C
ATOM 20 O UNL A 1 2.037 26.673 29.526 -0.32620000 1.520 O
ATOM 21 N UNL A 1 4.601 28.101 31.855 -0.19920000 1.550 N
ATOM 22 C UNL A 1 5.344 29.219 31.964 0.24200000 1.700 C
ATOM 23 O UNL A 1 5.135 30.151 31.320 -0.27330000 1.520 O
ATOM 24 C UNL A 1 6.425 29.144 32.986 0.09640000 1.700 C
ATOM 25 O UNL A 1 -0.037 26.732 32.558 -0.21760000 1.520 O
ATOM 26 O UNL A 1 1.845 29.086 32.860 -0.21830000 1.520 O
ATOM 27 C UNL A 1 -0.236 26.067 29.612 0.21420000 1.700 C
ATOM 28 O UNL A 1 -1.193 27.153 29.796 -0.21760000 1.520 O
ATOM 29 O UNL A 1 7.819 24.046 25.905 -0.32640000 1.520 O
ATOM 30 C UNL A 1 10.901 26.589 24.827 0.29170000 1.700 C
ATOM 31 C UNL A 1 10.261 25.882 23.605 0.18700000 1.700 C
ATOM 32 C UNL A 1 8.966 25.217 24.024 0.20630000 1.700 C
ATOM 33 C UNL A 1 9.239 24.360 25.310 0.17950000 1.700 C
ATOM 34 C UNL A 1 10.120 24.992 26.397 0.18030000 1.700 C
ATOM 35 O UNL A 1 11.337 25.508 25.740 -0.32430000 1.520 O
ATOM 36 N UNL A 1 10.041 26.872 22.532 -0.19910000 1.550 N
ATOM 37 C UNL A 1 10.851 27.003 21.453 0.24200000 1.700 C
ATOM 38 O UNL A 1 11.792 26.361 21.338 -0.27330000 1.520 O
ATOM 39 C UNL A 1 10.390 28.029 20.480 0.09640000 1.700 C
ATOM 40 O UNL A 1 8.456 24.320 23.027 -0.21840000 1.520 O
ATOM 41 O UNL A 1 12.111 27.155 24.334 -0.18790000 1.520 O
ATOM 42 C UNL A 1 10.575 24.007 27.445 0.21410000 1.700 C
ATOM 43 O UNL A 1 9.489 23.632 28.416 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 5
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 4.944 26.624 29.520 0.25860000 1.700 C
ATOM 2 C UNL A 1 3.733 26.147 28.517 0.18410000 1.700 C
ATOM 3 C UNL A 1 4.218 24.894 27.722 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.581 25.360 27.091 0.17950000 1.700 C
ATOM 5 C UNL A 1 6.666 25.758 28.206 0.18030000 1.700 C
ATOM 6 O UNL A 1 6.158 27.026 28.779 -0.32630000 1.520 O
ATOM 7 N UNL A 1 2.512 25.795 29.249 -0.19920000 1.550 N
ATOM 8 C UNL A 1 1.487 26.654 29.476 0.24200000 1.700 C
ATOM 9 O UNL A 1 1.544 27.762 29.171 -0.27330000 1.520 O
ATOM 10 C UNL A 1 0.298 26.041 30.140 0.09640000 1.700 C
ATOM 11 O UNL A 1 3.224 24.561 26.738 -0.21840000 1.520 O
ATOM 12 C UNL A 1 8.000 26.012 27.559 0.21410000 1.700 C
ATOM 13 O UNL A 1 7.771 27.055 26.489 -0.21760000 1.520 O
ATOM 14 O UNL A 1 6.227 24.350 26.259 -0.32640000 1.520 O
ATOM 15 C UNL A 1 6.571 24.165 24.858 0.25860000 1.700 C
ATOM 16 C UNL A 1 5.417 24.051 23.866 0.18420000 1.700 C
ATOM 17 C UNL A 1 5.943 23.658 22.522 0.20940000 1.700 C
ATOM 18 C UNL A 1 7.204 24.485 22.131 0.21360000 1.700 C
ATOM 19 C UNL A 1 8.235 24.668 23.264 0.18340000 1.700 C
ATOM 20 O UNL A 1 7.580 25.112 24.455 -0.32620000 1.520 O
ATOM 21 N UNL A 1 4.514 22.958 24.454 -0.19920000 1.550 N
ATOM 22 C UNL A 1 3.203 22.857 24.168 0.24200000 1.700 C
ATOM 23 O UNL A 1 2.611 23.735 23.715 -0.27330000 1.520 O
ATOM 24 C UNL A 1 2.607 21.525 24.468 0.09640000 1.700 C
ATOM 25 O UNL A 1 7.905 23.802 21.038 -0.21760000 1.520 O
ATOM 26 O UNL A 1 4.920 23.922 21.542 -0.21830000 1.520 O
ATOM 27 C UNL A 1 9.250 25.751 22.923 0.21420000 1.700 C
ATOM 28 O UNL A 1 10.336 25.252 22.085 -0.21760000 1.520 O
ATOM 29 O UNL A 1 4.484 27.794 30.296 -0.32640000 1.520 O
ATOM 30 C UNL A 1 4.457 31.880 30.952 0.29170000 1.700 C
ATOM 31 C UNL A 1 4.385 31.521 29.446 0.18700000 1.700 C
ATOM 32 C UNL A 1 4.092 30.043 29.290 0.20630000 1.700 C
ATOM 33 C UNL A 1 5.093 29.238 30.191 0.17950000 1.700 C
ATOM 34 C UNL A 1 5.360 29.785 31.600 0.18030000 1.700 C
ATOM 35 O UNL A 1 5.678 31.220 31.469 -0.32430000 1.520 O
ATOM 36 N UNL A 1 3.351 32.352 28.799 -0.19910000 1.550 N
ATOM 37 C UNL A 1 3.412 32.758 27.507 0.24200000 1.700 C
ATOM 38 O UNL A 1 4.313 32.502 26.849 -0.27330000 1.520 O
ATOM 39 C UNL A 1 2.224 33.536 27.067 0.09640000 1.700 C
ATOM 40 O UNL A 1 4.278 29.581 27.944 -0.21840000 1.520 O
ATOM 41 O UNL A 1 4.758 33.271 30.986 -0.18790000 1.520 O
ATOM 42 C UNL A 1 6.542 29.136 32.279 0.21410000 1.700 C
ATOM 43 O UNL A 1 7.309 28.210 31.376 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 6
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 3.357 27.313 28.657 0.25860000 1.700 C
ATOM 2 C UNL A 1 2.957 25.725 28.514 0.18410000 1.700 C
ATOM 3 C UNL A 1 4.222 24.939 28.045 0.20620000 1.700 C
ATOM 4 C UNL A 1 4.688 25.719 26.762 0.17950000 1.700 C
ATOM 5 C UNL A 1 5.075 27.245 27.080 0.18030000 1.700 C
ATOM 6 O UNL A 1 3.778 27.901 27.369 -0.32630000 1.520 O
ATOM 7 N UNL A 1 2.491 25.153 29.782 -0.19920000 1.550 N
ATOM 8 C UNL A 1 3.238 25.101 30.913 0.24200000 1.700 C
ATOM 9 O UNL A 1 4.338 25.437 30.931 -0.27330000 1.520 O
ATOM 10 C UNL A 1 2.514 24.582 32.112 0.09640000 1.700 C
ATOM 11 O UNL A 1 3.844 23.579 27.775 -0.21840000 1.520 O
ATOM 12 C UNL A 1 5.688 27.885 25.865 0.21410000 1.700 C
ATOM 13 O UNL A 1 4.665 28.858 25.325 -0.21760000 1.520 O
ATOM 14 O UNL A 1 5.861 25.145 26.111 -0.32640000 1.520 O
ATOM 15 C UNL A 1 7.192 24.696 26.487 0.25860000 1.700 C
ATOM 16 C UNL A 1 8.295 24.834 25.442 0.18420000 1.700 C
ATOM 17 C UNL A 1 9.531 24.138 25.916 0.20940000 1.700 C
ATOM 18 C UNL A 1 9.847 24.473 27.404 0.21360000 1.700 C
ATOM 19 C UNL A 1 8.624 24.455 28.345 0.18340000 1.700 C
ATOM 20 O UNL A 1 7.559 25.221 27.778 -0.32620000 1.520 O
ATOM 21 N UNL A 1 7.720 24.160 24.188 -0.19920000 1.550 N
ATOM 22 C UNL A 1 7.311 24.848 23.106 0.24200000 1.700 C
ATOM 23 O UNL A 1 7.085 25.977 23.156 -0.27330000 1.520 O
ATOM 24 C UNL A 1 7.200 24.035 21.863 0.09640000 1.700 C
ATOM 25 O UNL A 1 10.790 23.479 27.929 -0.21760000 1.520 O
ATOM 26 O UNL A 1 10.641 24.593 25.116 -0.21830000 1.520 O
ATOM 27 C UNL A 1 8.941 25.114 29.681 0.21420000 1.700 C
ATOM 28 O UNL A 1 10.126 24.544 30.316 -0.21760000 1.520 O
ATOM 29 O UNL A 1 2.172 28.059 29.126 -0.32640000 1.520 O
ATOM 30 C UNL A 1 4.002 30.352 32.046 0.29170000 1.700 C
ATOM 31 C UNL A 1 2.855 29.478 32.611 0.18700000 1.700 C
ATOM 32 C UNL A 1 2.438 28.455 31.575 0.20630000 1.700 C
ATOM 33 C UNL A 1 2.196 29.194 30.212 0.17950000 1.700 C
ATOM 34 C UNL A 1 3.217 30.268 29.809 0.18030000 1.700 C
ATOM 35 O UNL A 1 3.399 31.166 30.965 -0.32430000 1.520 O
ATOM 36 N UNL A 1 3.305 28.834 33.860 -0.19910000 1.550 N
ATOM 37 C UNL A 1 2.562 28.786 34.993 0.24200000 1.700 C
ATOM 38 O UNL A 1 1.535 29.290 35.048 -0.27330000 1.520 O
ATOM 39 C UNL A 1 3.206 28.032 36.100 0.09640000 1.700 C
ATOM 40 O UNL A 1 1.210 27.792 31.913 -0.21840000 1.520 O
ATOM 41 O UNL A 1 4.298 31.286 33.079 -0.18790000 1.520 O
ATOM 42 C UNL A 1 2.757 31.127 28.657 0.21410000 1.700 C
ATOM 43 O UNL A 1 2.900 30.452 27.321 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 7
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 3.446 27.041 31.074 0.25860000 1.700 C
ATOM 2 C UNL A 1 2.768 26.550 29.660 0.18410000 1.700 C
ATOM 3 C UNL A 1 3.717 25.503 28.997 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.107 26.236 28.953 0.17950000 1.700 C
ATOM 5 C UNL A 1 5.645 26.615 30.418 0.18030000 1.700 C
ATOM 6 O UNL A 1 4.749 27.707 30.868 -0.32630000 1.520 O
ATOM 7 N UNL A 1 1.453 25.934 29.859 -0.19920000 1.550 N
ATOM 8 C UNL A 1 0.274 26.560 29.615 0.24200000 1.700 C
ATOM 9 O UNL A 1 0.228 27.667 29.305 -0.27330000 1.520 O
ATOM 10 C UNL A 1 -0.933 25.697 29.778 0.09640000 1.700 C
ATOM 11 O UNL A 1 3.206 25.180 27.692 -0.21840000 1.520 O
ATOM 12 C UNL A 1 7.051 27.140 30.331 0.21410000 1.700 C
ATOM 13 O UNL A 1 7.969 25.957 30.540 -0.21760000 1.520 O
ATOM 14 O UNL A 1 6.173 25.454 28.335 -0.32640000 1.520 O
ATOM 15 C UNL A 1 6.615 25.101 26.996 0.25860000 1.700 C
ATOM 16 C UNL A 1 8.021 24.525 26.855 0.18420000 1.700 C
ATOM 17 C UNL A 1 8.380 24.419 25.407 0.20940000 1.700 C
ATOM 18 C UNL A 1 7.220 23.807 24.567 0.21360000 1.700 C
ATOM 19 C UNL A 1 5.817 24.355 24.905 0.18340000 1.700 C
ATOM 20 O UNL A 1 5.608 24.322 26.319 -0.32620000 1.520 O
ATOM 21 N UNL A 1 8.921 25.534 27.581 -0.19920000 1.550 N
ATOM 22 C UNL A 1 10.166 25.238 28.000 0.24200000 1.700 C
ATOM 23 O UNL A 1 10.525 24.149 28.111 -0.27330000 1.520 O
ATOM 24 C UNL A 1 11.021 26.425 28.279 0.09640000 1.700 C
ATOM 25 O UNL A 1 7.449 24.100 23.147 -0.21760000 1.520 O
ATOM 26 O UNL A 1 9.521 23.545 25.288 -0.21830000 1.520 O
ATOM 27 C UNL A 1 4.721 23.484 24.305 0.21420000 1.700 C
ATOM 28 O UNL A 1 3.507 23.482 25.115 -0.21760000 1.520 O
ATOM 29 O UNL A 1 2.543 28.013 31.721 -0.32640000 1.520 O
ATOM 30 C UNL A 1 3.065 26.949 35.687 0.29170000 1.700 C
ATOM 31 C UNL A 1 1.809 26.295 35.058 0.18700000 1.700 C
ATOM 32 C UNL A 1 1.843 26.471 33.554 0.20630000 1.700 C
ATOM 33 C UNL A 1 2.123 27.982 33.235 0.17950000 1.700 C
ATOM 34 C UNL A 1 3.196 28.687 34.078 0.18030000 1.700 C
ATOM 35 O UNL A 1 2.902 28.409 35.497 -0.32430000 1.520 O
ATOM 36 N UNL A 1 1.763 24.869 35.438 -0.19910000 1.550 N
ATOM 37 C UNL A 1 0.731 24.301 36.108 0.24200000 1.700 C
ATOM 38 O UNL A 1 -0.163 24.927 36.456 -0.27330000 1.520 O
ATOM 39 C UNL A 1 0.889 22.839 36.323 0.09640000 1.700 C
ATOM 40 O UNL A 1 0.596 26.138 32.928 -0.21840000 1.520 O
ATOM 41 O UNL A 1 2.922 26.750 37.089 -0.18790000 1.520 O
ATOM 42 C UNL A 1 3.191 30.187 33.917 0.21410000 1.700 C
ATOM 43 O UNL A 1 2.235 30.667 32.859 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 8
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 6.411 26.530 27.332 0.25860000 1.700 C
ATOM 2 C UNL A 1 7.302 26.451 28.711 0.18410000 1.700 C
ATOM 3 C UNL A 1 6.335 26.582 29.930 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.530 27.897 29.626 0.17950000 1.700 C
ATOM 5 C UNL A 1 4.687 27.797 28.262 0.18030000 1.700 C
ATOM 6 O UNL A 1 5.712 27.824 27.192 -0.32630000 1.520 O
ATOM 7 N UNL A 1 8.036 25.187 28.826 -0.19920000 1.550 N
ATOM 8 C UNL A 1 9.352 25.042 28.531 0.24200000 1.700 C
ATOM 9 O UNL A 1 9.973 25.901 28.085 -0.27330000 1.520 O
ATOM 10 C UNL A 1 9.912 23.692 28.837 0.09640000 1.700 C
ATOM 11 O UNL A 1 7.119 26.663 31.132 -0.21840000 1.520 O
ATOM 12 C UNL A 1 3.796 29.000 28.118 0.21410000 1.700 C
ATOM 13 O UNL A 1 2.418 28.576 28.572 -0.21760000 1.520 O
ATOM 14 O UNL A 1 4.564 28.255 30.658 -0.32640000 1.520 O
ATOM 15 C UNL A 1 3.729 27.578 31.637 0.25860000 1.700 C
ATOM 16 C UNL A 1 3.925 27.957 33.102 0.18420000 1.700 C
ATOM 17 C UNL A 1 3.146 27.024 33.974 0.20940000 1.700 C
ATOM 18 C UNL A 1 1.702 26.798 33.433 0.21360000 1.700 C
ATOM 19 C UNL A 1 1.609 26.579 31.909 0.18340000 1.700 C
ATOM 20 O UNL A 1 2.348 27.593 31.223 -0.32620000 1.520 O
ATOM 21 N UNL A 1 5.435 27.809 33.336 -0.19920000 1.550 N
ATOM 22 C UNL A 1 6.089 28.443 34.328 0.24200000 1.700 C
ATOM 23 O UNL A 1 5.635 29.351 34.870 -0.27330000 1.520 O
ATOM 24 C UNL A 1 7.418 27.858 34.661 0.09640000 1.700 C
ATOM 25 O UNL A 1 1.137 25.598 34.061 -0.21760000 1.520 O
ATOM 26 O UNL A 1 3.039 27.614 35.285 -0.21830000 1.520 O
ATOM 27 C UNL A 1 0.174 26.709 31.415 0.21420000 1.700 C
ATOM 28 O UNL A 1 -0.730 27.191 32.454 -0.21760000 1.520 O
ATOM 29 O UNL A 1 7.315 26.381 26.175 -0.32640000 1.520 O
ATOM 30 C UNL A 1 5.978 24.615 22.678 0.29170000 1.700 C
ATOM 31 C UNL A 1 5.512 23.852 23.944 0.18700000 1.700 C
ATOM 32 C UNL A 1 5.767 24.702 25.172 0.20630000 1.700 C
ATOM 33 C UNL A 1 7.249 25.213 25.126 0.17950000 1.700 C
ATOM 34 C UNL A 1 7.775 25.710 23.772 0.18030000 1.700 C
ATOM 35 O UNL A 1 7.455 24.681 22.764 -0.32430000 1.520 O
ATOM 36 N UNL A 1 4.083 23.511 23.806 -0.19910000 1.550 N
ATOM 37 C UNL A 1 3.479 22.507 24.490 0.24200000 1.700 C
ATOM 38 O UNL A 1 4.074 21.832 25.198 -0.27330000 1.520 O
ATOM 39 C UNL A 1 2.020 22.396 24.225 0.09640000 1.700 C
ATOM 40 O UNL A 1 5.618 23.966 26.396 -0.21840000 1.520 O
ATOM 41 O UNL A 1 5.719 23.728 21.596 -0.18790000 1.520 O
ATOM 42 C UNL A 1 9.273 25.897 23.745 0.21410000 1.700 C
ATOM 43 O UNL A 1 9.941 25.513 25.036 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 9
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 7.689 26.585 25.941 0.25860000 1.700 C
ATOM 2 C UNL A 1 8.560 26.630 27.334 0.18410000 1.700 C
ATOM 3 C UNL A 1 7.782 27.498 28.372 0.20620000 1.700 C
ATOM 4 C UNL A 1 7.515 28.844 27.606 0.17950000 1.700 C
ATOM 5 C UNL A 1 6.622 28.631 26.288 0.18030000 1.700 C
ATOM 6 O UNL A 1 7.521 27.926 25.343 -0.32630000 1.520 O
ATOM 7 N UNL A 1 8.771 25.294 27.900 -0.19920000 1.550 N
ATOM 8 C UNL A 1 9.895 24.915 28.559 0.24200000 1.700 C
ATOM 9 O UNL A 1 10.809 25.608 28.648 -0.27330000 1.520 O
ATOM 10 C UNL A 1 9.837 23.545 29.150 0.09640000 1.700 C
ATOM 11 O UNL A 1 8.605 27.665 29.540 -0.21840000 1.520 O
ATOM 12 C UNL A 1 6.241 29.962 25.702 0.21410000 1.700 C
ATOM 13 O UNL A 1 4.778 29.872 25.335 -0.21760000 1.520 O
ATOM 14 O UNL A 1 6.813 29.849 28.396 -0.32640000 1.520 O
ATOM 15 C UNL A 1 5.629 29.928 29.237 0.25860000 1.700 C
ATOM 16 C UNL A 1 4.441 30.718 28.697 0.18420000 1.700 C
ATOM 17 C UNL A 1 3.406 30.870 29.766 0.20940000 1.700 C
ATOM 18 C UNL A 1 3.151 29.529 30.517 0.21360000 1.700 C
ATOM 19 C UNL A 1 4.424 28.736 30.877 0.18340000 1.700 C
ATOM 20 O UNL A 1 5.270 28.622 29.730 -0.32620000 1.520 O
ATOM 21 N UNL A 1 5.035 32.076 28.297 -0.19920000 1.550 N
ATOM 22 C UNL A 1 4.479 32.876 27.368 0.24200000 1.700 C
ATOM 23 O UNL A 1 3.709 32.479 26.609 -0.27330000 1.520 O
ATOM 24 C UNL A 1 4.928 34.295 27.427 0.09640000 1.700 C
ATOM 25 O UNL A 1 2.464 29.811 31.782 -0.21760000 1.520 O
ATOM 26 O UNL A 1 2.170 31.271 29.144 -0.21830000 1.520 O
ATOM 27 C UNL A 1 4.091 27.308 31.288 0.21420000 1.700 C
ATOM 28 O UNL A 1 5.166 26.372 30.970 -0.21760000 1.520 O
ATOM 29 O UNL A 1 8.406 25.745 24.961 -0.32640000 1.520 O
ATOM 30 C UNL A 1 5.641 24.474 22.155 0.29170000 1.700 C
ATOM 31 C UNL A 1 5.438 23.799 23.535 0.18700000 1.700 C
ATOM 32 C UNL A 1 6.267 24.519 24.579 0.20630000 1.700 C
ATOM 33 C UNL A 1 7.732 24.664 24.040 0.17950000 1.700 C
ATOM 34 C UNL A 1 7.899 25.070 22.568 0.18030000 1.700 C
ATOM 35 O UNL A 1 7.038 24.183 21.762 -0.32430000 1.520 O
ATOM 36 N UNL A 1 4.002 23.813 23.876 -0.19910000 1.550 N
ATOM 37 C UNL A 1 3.393 22.848 24.608 0.24200000 1.700 C
ATOM 38 O UNL A 1 3.971 21.931 24.975 -0.27330000 1.520 O
ATOM 39 C UNL A 1 1.954 23.114 24.869 0.09640000 1.700 C
ATOM 40 O UNL A 1 6.348 23.797 25.817 -0.21840000 1.520 O
ATOM 41 O UNL A 1 4.846 23.713 21.252 -0.18790000 1.520 O
ATOM 42 C UNL A 1 9.308 24.895 22.056 0.21410000 1.700 C
ATOM 43 O UNL A 1 10.350 25.454 22.986 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 10
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 5.655 26.829 27.360 0.25860000 1.700 C
ATOM 2 C UNL A 1 6.440 26.668 28.794 0.18410000 1.700 C
ATOM 3 C UNL A 1 5.379 26.673 29.939 0.20620000 1.700 C
ATOM 4 C UNL A 1 4.554 27.984 29.675 0.17950000 1.700 C
ATOM 5 C UNL A 1 3.821 27.968 28.246 0.18030000 1.700 C
ATOM 6 O UNL A 1 4.923 28.109 27.265 -0.32630000 1.520 O
ATOM 7 N UNL A 1 7.208 25.420 28.870 -0.19920000 1.550 N
ATOM 8 C UNL A 1 8.553 25.343 28.712 0.24200000 1.700 C
ATOM 9 O UNL A 1 9.184 26.261 28.424 -0.27330000 1.520 O
ATOM 10 C UNL A 1 9.130 23.987 28.948 0.09640000 1.700 C
ATOM 11 O UNL A 1 6.067 26.682 31.203 -0.21840000 1.520 O
ATOM 12 C UNL A 1 2.902 29.152 28.124 0.21410000 1.700 C
ATOM 13 O UNL A 1 1.601 28.760 28.788 -0.21760000 1.520 O
ATOM 14 O UNL A 1 3.500 28.231 30.652 -0.32640000 1.520 O
ATOM 15 C UNL A 1 3.138 27.780 31.986 0.25860000 1.700 C
ATOM 16 C UNL A 1 2.409 26.444 32.097 0.18420000 1.700 C
ATOM 17 C UNL A 1 1.933 26.242 33.501 0.20940000 1.700 C
ATOM 18 C UNL A 1 3.039 26.595 34.541 0.21360000 1.700 C
ATOM 19 C UNL A 1 3.819 27.892 34.242 0.18340000 1.700 C
ATOM 20 O UNL A 1 4.261 27.894 32.882 -0.32620000 1.520 O
ATOM 21 N UNL A 1 1.231 26.571 31.121 -0.19920000 1.550 N
ATOM 22 C UNL A 1 1.071 25.764 30.055 0.24200000 1.700 C
ATOM 23 O UNL A 1 1.939 25.134 29.636 -0.27330000 1.520 O
ATOM 24 C UNL A 1 -0.310 25.748 29.495 0.09640000 1.700 C
ATOM 25 O UNL A 1 2.417 26.777 35.857 -0.21760000 1.520 O
ATOM 26 O UNL A 1 1.596 24.851 33.667 -0.21830000 1.520 O
ATOM 27 C UNL A 1 5.083 27.987 35.087 0.21420000 1.700 C
ATOM 28 O UNL A 1 4.848 28.651 36.365 -0.21760000 1.520 O
ATOM 29 O UNL A 1 6.649 26.799 26.269 -0.32640000 1.520 O
ATOM 30 C UNL A 1 5.801 24.789 22.752 0.29170000 1.700 C
ATOM 31 C UNL A 1 5.394 23.980 24.010 0.18700000 1.700 C
ATOM 32 C UNL A 1 5.444 24.878 25.229 0.20630000 1.700 C
ATOM 33 C UNL A 1 6.827 25.619 25.246 0.17950000 1.700 C
ATOM 34 C UNL A 1 7.339 26.174 23.909 0.18030000 1.700 C
ATOM 35 O UNL A 1 7.242 25.092 22.910 -0.32430000 1.520 O
ATOM 36 N UNL A 1 4.047 23.412 23.807 -0.19910000 1.550 N
ATOM 37 C UNL A 1 3.532 22.410 24.561 0.24200000 1.700 C
ATOM 38 O UNL A 1 4.149 21.916 25.390 -0.27330000 1.520 O
ATOM 39 C UNL A 1 2.135 22.050 24.203 0.09640000 1.700 C
ATOM 40 O UNL A 1 5.349 24.146 26.460 -0.21840000 1.520 O
ATOM 41 O UNL A 1 5.745 23.855 21.679 -0.18790000 1.520 O
ATOM 42 C UNL A 1 8.787 26.598 23.953 0.21410000 1.700 C
ATOM 43 O UNL A 1 9.363 26.594 25.343 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42
CONECT 35 30 34
CONECT 36 31 37
CONECT 37 36 38 39
CONECT 38 37
CONECT 39 37
CONECT 40 32
CONECT 41 30
CONECT 42 34 43
CONECT 43 42
MASTER 0 0 0 0 0 0 0 0 43 0 43 0
END
ENDMDL
MODEL 11
COMPND *****
AUTHOR GENERATED BY OPEN BABEL 2.3.2
ATOM 1 C UNL A 1 6.853 24.185 26.857 0.25860000 1.700 C
ATOM 2 C UNL A 1 7.659 25.452 27.524 0.18410000 1.700 C
ATOM 3 C UNL A 1 6.959 25.828 28.868 0.20620000 1.700 C
ATOM 4 C UNL A 1 5.453 26.021 28.461 0.17950000 1.700 C
ATOM 5 C UNL A 1 4.805 24.681 27.858 0.18030000 1.700 C
ATOM 6 O UNL A 1 5.451 24.522 26.534 -0.32630000 1.520 O
ATOM 7 N UNL A 1 9.064 25.134 27.798 -0.19920000 1.550 N
ATOM 8 C UNL A 1 10.081 26.025 27.689 0.24200000 1.700 C
ATOM 9 O UNL A 1 9.915 27.090 27.288 -0.27330000 1.520 O
ATOM 10 C UNL A 1 11.410 25.508 28.132 0.09640000 1.700 C
ATOM 11 O UNL A 1 7.565 27.026 29.383 -0.21840000 1.520 O
ATOM 12 C UNL A 1 3.326 24.867 27.663 0.21410000 1.700 C
ATOM 13 O UNL A 1 2.904 23.888 26.591 -0.21760000 1.520 O
ATOM 14 O UNL A 1 4.585 26.414 29.565 -0.32640000 1.520 O
ATOM 15 C UNL A 1 4.109 27.643 30.180 0.25860000 1.700 C
ATOM 16 C UNL A 1 2.914 27.535 31.122 0.18420000 1.700 C
ATOM 17 C UNL A 1 2.435 28.903 31.491 0.20940000 1.700 C
ATOM 18 C UNL A 1 3.617 29.846 31.866 0.21360000 1.700 C
ATOM 19 C UNL A 1 4.839 29.757 30.929 0.18340000 1.700 C
ATOM 20 O UNL A 1 5.209 28.390 30.737 -0.32620000 1.520 O
ATOM 21 N UNL A 1 1.857 26.773 30.310 -0.19920000 1.550 N
ATOM 22 C UNL A 1 0.843 26.094 30.880 0.24200000 1.700 C
ATOM 23 O UNL A 1 0.867 25.789 31.990 -0.27330000 1.520 O
ATOM 24 C UNL A 1 -0.293 25.798 29.963 0.09640000 1.700 C
ATOM 25 O UNL A 1 3.154 31.238 31.816 -0.21760000 1.520 O
ATOM 26 O UNL A 1 1.579 28.786 32.644 -0.21830000 1.520 O
ATOM 27 C UNL A 1 6.059 30.433 31.541 0.21420000 1.700 C
ATOM 28 O UNL A 1 7.097 29.476 31.913 -0.21760000 1.520 O
ATOM 29 O UNL A 1 7.524 23.807 25.597 -0.32640000 1.520 O
ATOM 30 C UNL A 1 7.960 24.170 21.497 0.29170000 1.700 C
ATOM 31 C UNL A 1 8.760 25.244 22.276 0.18700000 1.700 C
ATOM 32 C UNL A 1 8.808 24.877 23.744 0.20630000 1.700 C
ATOM 33 C UNL A 1 7.350 24.554 24.225 0.17950000 1.700 C
ATOM 34 C UNL A 1 6.476 23.707 23.289 0.18030000 1.700 C
ATOM 35 O UNL A 1 6.554 24.307 21.943 -0.32430000 1.520 O
ATOM 36 N UNL A 1 10.114 25.354 21.698 -0.19910000 1.550 N
ATOM 37 C UNL A 1 10.804 26.518 21.613 0.24200000 1.700 C
ATOM 38 O UNL A 1 10.341 27.506 21.960 -0.27330000 1.520 O
ATOM 39 C UNL A 1 12.170 26.364 21.047 0.09640000 1.700 C
ATOM 40 O UNL A 1 9.290 25.948 24.568 -0.21840000 1.520 O
ATOM 41 O UNL A 1 7.955 24.620 20.146 -0.18790000 1.520 O
ATOM 42 C UNL A 1 5.019 23.696 23.679 0.21410000 1.700 C
ATOM 43 O UNL A 1 4.642 22.516 24.532 -0.21760000 1.520 O
CONECT 1 29 2 6
CONECT 2 1 7 3
CONECT 3 2 11 4
CONECT 4 3 14 5
CONECT 5 4 6 12
CONECT 6 1 5
CONECT 7 2 8
CONECT 8 7 9 10
CONECT 9 8
CONECT 10 8
CONECT 11 3
CONECT 12 5 13
CONECT 13 12
CONECT 14 4 15
CONECT 15 14 16 20
CONECT 16 15 21 17
CONECT 17 16 26 18
CONECT 18 17 25 19
CONECT 19 18 20 27
CONECT 20 15 19
CONECT 21 16 22
CONECT 22 21 23 24
CONECT 23 22
CONECT 24 22
CONECT 25 18
CONECT 26 17
CONECT 27 19 28
CONECT 28 27
CONECT 29 1 33
CONECT 30 41 31 35
CONECT 31 30 36 32
CONECT 32 31 40 33
CONECT 33 32 29 34
CONECT 34 33 35 42