# generated using pymatgen
data_C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   36.46723426
_cell_length_b   36.45621030
_cell_length_c   52.67255432
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.46304097
_symmetry_Int_Tables_number   1
_chemical_formula_structural   C
_chemical_formula_sum   C1920
_cell_volume   68611.0939408
_cell_formula_units_Z   1920
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  C  C1  1  0.527594  0.397208  0.290724  1
  C  C2  1  0.027594  0.897208  0.290724  1
  C  C3  1  0.945928  0.311747  0.414218  1
  C  C4  1  0.445928  0.811747  0.414218  1
  C  C5  1  0.474625  0.339746  0.372327  1
  C  C6  1  0.974625  0.839746  0.372327  1
  C  C7  1  0.891549  0.257408  0.496687  1
  C  C8  1  0.391549  0.757408  0.496687  1
  C  C9  1  0.525894  0.377346  0.492612  1
  C  C10  1  0.025894  0.877346  0.492612  1
  C  C11  1  0.109461  0.461133  0.367909  1
  C  C12  1  0.609461  0.961133  0.367909  1
  C  C13  1  0.610817  0.416389  0.457936  1
  C  C14  1  0.110817  0.916389  0.457936  1
  C  C15  1  0.195753  0.499036  0.331708  1
  C  C16  1  0.695753  -0.000965  0.331708  1
  C  C17  1  0.671687  0.477211  0.365623  1
  C  C18  1  0.171687  0.977211  0.365623  1
  C  C19  1  0.088268  0.393934  0.490820  1
  C  C20  1  0.588268  0.893934  0.490820  1
  C  C21  1  0.683737  0.620396  0.268960  1
  C  C22  1  0.183737  0.120396  0.268960  1
  C  C23  1  0.095872  0.529270  0.388603  1
  C  C24  1  0.595872  0.029270  0.388603  1
  C  C25  1  0.511281  0.337688  0.491181  1
  C  C26  1  0.011281  0.837688  0.491181  1
  C  C27  1  0.094875  0.421468  0.366375  1
  C  C28  1  0.594875  0.921468  0.366375  1
  C  C29  1  0.596352  0.357776  0.281722  1
  C  C30  1  0.096352  0.857776  0.281722  1
  C  C31  1  0.016281  0.275056  0.407838  1
  C  C32  1  0.516281  0.775056  0.407838  1
  C  C33  1  0.571603  0.357541  0.257558  1
  C  C34  1  0.071604  0.857541  0.257558  1
  C  C35  1  0.991631  0.266010  0.383223  1
  C  C36  1  0.491631  0.766010  0.383223  1
  C  C37  1  0.574915  0.381537  0.333241  1
  C  C38  1  0.074915  0.881537  0.333241  1
  C  C39  1  0.992832  0.298534  0.457836  1
  C  C40  1  0.492832  0.798534  0.457836  1
  C  C41  1  0.666163  0.484735  0.271044  1
  C  C42  1  0.166163  0.984735  0.271044  1
  C  C43  1  0.077973  0.404620  0.391902  1
  C  C44  1  0.577973  0.904620  0.391902  1
  C  C45  1  0.708939  0.652124  0.357499  1
  C  C46  1  0.208939  0.152124  0.357499  1
  C  C47  1  0.125305  0.568387  0.482469  1
  C  C48  1  0.625305  0.068387  0.482469  1
  C  C49  1  0.695001  0.579226  0.274951  1
  C  C50  1  0.195001  0.079226  0.274951  1
  C  C51  1  0.107222  0.484159  0.394975  1
  C  C52  1  0.607222  0.984159  0.394975  1
  C  C53  1  0.622980  0.518252  0.310809  1
  C  C54  1  0.122980  0.018252  0.310809  1
  C  C55  1  0.038430  0.431146  0.437029  1
  C  C56  1  0.538430  0.931146  0.437029  1
  C  C57  1  0.629204  0.628797  0.307109  1
  C  C58  1  0.129204  0.128797  0.307109  1
  C  C59  1  0.050866  0.540537  0.433184  1
  C  C60  1  0.550866  0.040537  0.433184  1
  C  C61  1  0.723294  0.400834  0.259879  1
  C  C62  1  0.223294  0.900834  0.259879  1
  C  C63  1  0.148803  0.321164  0.386929  1
  C  C64  1  0.648803  0.821164  0.386929  1
  C  C65  1  0.589924  0.496957  0.302357  1
  C  C66  1  0.089924  -0.003043  0.302357  1
  C  C67  1  0.003539  0.411842  0.428211  1
  C  C68  1  0.503539  0.911842  0.428211  1
  C  C69  1  0.675912  0.685246  0.345651  1
  C  C70  1  0.175912  0.185246  0.345651  1
  C  C71  1  0.092281  0.601470  0.470575  1
  C  C72  1  0.592281  0.101470  0.470575  1
  C  C73  1  0.648009  0.648198  0.281331  1
  C  C74  1  0.148009  0.148198  0.281331  1
  C  C75  1  0.067769  0.557385  0.407658  1
  C  C76  1  0.567769  0.057385  0.407658  1
  C  C77  1  0.569003  0.386826  0.302626  1
  C  C78  1  0.069003  0.886825  0.302626  1
  C  C79  1  0.988035  0.303323  0.426994  1
  C  C80  1  0.488035  0.803323  0.426994  1
  C  C81  1  0.585999  0.648850  0.309140  1
  C  C82  1  0.085999  0.148850  0.309140  1
  C  C83  1  0.007393  0.563245  0.437108  1
  C  C84  1  0.507393  0.063245  0.437108  1
  C  C85  1  0.602399  0.458515  0.470702  1
  C  C86  1  0.102399  0.958515  0.470702  1
  C  C87  1  0.186423  0.541099  0.345268  1
  C  C88  1  0.686423  0.041099  0.345268  1
  C  C89  1  0.552879  0.174769  0.483129  1
  C  C90  1  0.052879  0.674769  0.483129  1
  C  C91  1  0.136456  0.258476  0.358331  1
  C  C92  1  0.636456  0.758476  0.358331  1
  C  C93  1  0.754123  0.411914  0.279438  1
  C  C94  1  0.254123  0.911914  0.279438  1
  C  C95  1  0.173432  0.330154  0.411570  1
  C  C96  1  0.673432  0.830154  0.411570  1
  C  C97  1  0.605995  0.421203  0.426932  1
  C  C98  1  0.105995  0.921203  0.426932  1
  C  C99  1  0.192034  0.503917  0.301047  1
  C  C100  1  0.692034  0.003917  0.301048  1
  C  C101  1  0.582182  0.254296  0.485998  1
  C  C102  1  0.082182  0.754296  0.485998  1
  C  C103  1  0.165707  0.338013  0.361404  1
  C  C104  1  0.665707  0.838013  0.361404  1
  C  C105  1  0.518446  0.651128  0.380873  1
  C  C106  1  0.018446  0.151128  0.380873  1
  C  C107  1  0.114944  0.727161  0.254365  1
  C  C108  1  0.614944  0.227161  0.254365  1
  C  C109  1  0.546747  0.517006  0.304647  1
  C  C110  1  0.046747  0.017005  0.304647  1
  C  C111  1  0.960066  0.434549  0.432137  1
  C  C112  1  0.460066  0.934549  0.432137  1
  C  C113  1  0.643712  0.383481  0.469723  1
  C  C114  1  0.143712  0.883481  0.469723  1
  C  C115  1  0.227360  0.465971  0.344721  1
  C  C116  1  0.727359  0.965971  0.344721  1
  C  C117  1  0.650943  0.409919  0.382325  1
  C  C118  1  0.150943  0.909919  0.382325  1
  C  C119  1  0.231859  0.476358  0.253558  1
  C  C120  1  0.731858  0.976358  0.253558  1
  C  C121  1  0.568001  0.580854  0.326336  1
  C  C122  1  0.068001  0.080854  0.326336  1
  C  C123  1  0.986786  0.495842  0.453724  1
  C  C124  1  0.486786  0.995842  0.453724  1
  C  C125  1  0.625984  0.522948  0.396618  1
  C  C126  1  0.125984  0.022948  0.396618  1
  C  C127  1  0.208617  0.607299  0.271326  1
  C  C128  1  0.708617  0.107299  0.271326  1
  C  C129  1  0.626922  0.467513  0.495188  1
  C  C130  1  0.126922  0.967513  0.495188  1
  C  C131  1  0.210356  0.549721  0.370245  1
  C  C132  1  0.710356  0.049721  0.370246  1
  C  C133  1  0.534927  0.559159  0.316349  1
  C  C134  1  0.034927  0.059159  0.316349  1
  C  C135  1  0.951709  0.476440  0.444860  1
  C  C136  1  0.451709  0.976440  0.444860  1
  C  C137  1  0.639604  0.454786  0.375962  1
  C  C138  1  0.139604  0.954786  0.375962  1
  C  C139  1  0.056184  0.371508  0.501158  1
  C  C140  1  0.556184  0.871508  0.501158  1
  C  C141  1  0.594746  0.470285  0.274844  1
  C  C142  1  0.094746  0.970285  0.274844  1
  C  C143  1  0.005777  0.388818  0.401144  1
  C  C144  1  0.505777  0.888818  0.401144  1
  C  C145  1  0.538062  0.385208  0.352048  1
  C  C146  1  0.038062  0.885208  0.352048  1
  C  C147  1  0.955547  0.302144  0.476065  1
  C  C148  1  0.455547  0.802144  0.476065  1
  C  C149  1  0.656586  0.246867  0.449639  1
  C  C150  1  0.156586  0.746867  0.449639  1
  C  C151  1  0.240141  0.330788  0.325094  1
  C  C152  1  0.740141  0.830788  0.325094  1
  C  C153  1  0.714941  0.454653  0.361701  1
  C  C154  1  0.214941  0.954653  0.361701  1
  C  C155  1  0.131521  0.371377  0.486898  1
  C  C156  1  0.631521  0.871377  0.486898  1
  C  C157  1  0.617282  0.273715  0.494787  1
  C  C158  1  0.117282  0.773715  0.494787  1
  C  C159  1  0.200782  0.357416  0.370269  1
  C  C160  1  0.700782  0.857416  0.370269  1
  C  C161  1  0.554680  0.625513  0.318546  1
  C  C162  1  0.054680  0.125513  0.318546  1
  C  C163  1  0.975439  0.540954  0.447351  1
  C  C164  1  0.475439  0.040954  0.447351  1
  C  C165  1  0.533072  0.691023  0.382373  1
  C  C166  1  0.033072  0.191023  0.382373  1
  C  C167  1  0.127470  0.764293  0.255530  1
  C  C168  1  0.627470  0.264294  0.255530  1
  C  C169  1  0.458366  0.432174  0.433088  1
  C  C170  1  0.958366  0.932174  0.433088  1
  C  C171  1  0.041967  0.516191  0.308446  1
  C  C172  1  0.541967  0.016191  0.308446  1
  C  C173  1  0.660988  0.515845  0.292880  1
  C  C174  1  0.160988  0.015845  0.292880  1
  C  C175  1  0.075745  0.427524  0.418828  1
  C  C176  1  0.575745  0.927524  0.418828  1
  C  C177  1  0.611358  0.483052  0.395118  1
  C  C178  1  0.111358  0.983052  0.395118  1
  C  C179  1  0.188742  0.572515  0.271164  1
  C  C180  1  0.688742  0.072515  0.271164  1
  C  C181  1  0.636452  0.463760  0.262893  1
  C  C182  1  0.136452  0.963760  0.262893  1
  C  C183  1  0.042898  0.385216  0.383038  1
  C  C184  1  0.542898  0.885216  0.383038  1
  C  C185  1  0.515923  0.408128  0.469452  1
  C  C186  1  0.015923  0.908128  0.469452  1
  C  C187  1  0.099496  0.492014  0.344809  1
  C  C188  1  0.599496  0.992014  0.344809  1
  C  C189  1  0.663270  0.519338  0.378389  1
  C  C190  1  0.163270  0.019338  0.378389  1
  C  C191  1  0.241235  0.614192  0.253482  1
  C  C192  1  0.741235  0.114192  0.253482  1
  C  C193  1  0.736288  0.679389  0.316198  1
  C  C194  1  0.236288  0.179389  0.316198  1
  C  C195  1  0.152631  0.595446  0.441084  1
  C  C196  1  0.652631  0.095446  0.441084  1
  C  C197  1  0.673540  0.557405  0.294543  1
  C  C198  1  0.173540  0.057405  0.294543  1
  C  C199  1  0.090409  0.467396  0.420368  1
  C  C200  1  0.590409  0.967396  0.420368  1
  C  C201  1  0.454487  0.306265  0.476959  1
  C  C202  1  0.954487  0.806265  0.476959  1
  C  C203  1  0.038122  0.390071  0.352033  1
  C  C204  1  0.538122  0.890071  0.352033  1
  C  C205  1  0.476339  0.659552  0.368097  1
  C  C206  1  0.976339  0.159552  0.368097  1
  C  C207  1  0.892918  0.576276  0.493295  1
  C  C208  1  0.392918  0.076276  0.493295  1
  C  C209  1  0.628880  0.323521  0.293717  1
  C  C210  1  0.128879  0.823521  0.293717  1
  C  C211  1  0.049176  0.242148  0.419625  1
  C  C212  1  0.549176  0.742148  0.419625  1
  C  C213  1  0.642773  0.584597  0.313291  1
  C  C214  1  0.142773  0.084597  0.313291  1
  C  C215  1  0.062158  0.495660  0.439522  1
  C  C216  1  0.562158  0.995660  0.439522  1
  C  C217  1  0.486618  0.328602  0.466584  1
  C  C218  1  0.986618  0.828602  0.466584  1
  C  C219  1  0.070245  0.412476  0.341735  1
  C  C220  1  0.570245  0.912476  0.341735  1
  C  C221  1  0.611906  0.560449  0.323476  1
  C  C222  1  0.111906  0.060449  0.323476  1
  C  C223  1  0.030033  0.473257  0.449819  1
  C  C224  1  0.530033  0.973257  0.449819  1
  C  C225  1  0.711873  0.363761  0.258833  1
  C  C226  1  0.211873  0.863761  0.258833  1
  C  C227  1  0.134217  0.281499  0.385399  1
  C  C228  1  0.634217  0.781499  0.385399  1
  C  C229  1  0.454447  0.606394  0.401496  1
  C  C230  1  0.954447  0.106394  0.401496  1
  C  C231  1  0.037985  0.685071  0.276111  1
  C  C232  1  0.537985  0.185071  0.276112  1
  C  C233  1  0.553797  0.474926  0.264139  1
  C  C234  1  0.053797  0.974927  0.264139  1
  C  C235  1  0.963687  0.397295  0.388343  1
  C  C236  1  0.463687  0.897295  0.388343  1
  C  C237  1  0.495963  0.394010  0.339892  1
  C  C238  1  0.995963  0.894010  0.339892  1
  C  C239  1  0.913659  0.310524  0.463356  1
  C  C240  1  0.413659  0.810524  0.463356  1
  C  C241  1  0.695928  0.561747  0.414218  1
  C  C242  1  0.195928  0.061747  0.414218  1
  C  C243  1  0.277593  0.647208  0.290724  1
  C  C244  1  0.777594  0.147208  0.290724  1
  C  C245  1  0.641549  0.507408  0.496687  1
  C  C246  1  0.141549  0.007408  0.496687  1
  C  C247  1  0.224625  0.589746  0.372327  1
  C  C248  1  0.724625  0.089746  0.372327  1
  C  C249  1  0.275894  0.627346  0.492612  1
  C  C250  1  0.775894  0.127346  0.492612  1
  C  C251  1  0.859461  0.711133  0.367909  1
  C  C252  1  0.359461  0.211133  0.367909  1
  C  C253  1  0.360817  0.666389  0.457936  1
  C  C254  1  0.860817  0.166389  0.457936  1
  C  C255  1  0.945753  0.749036  0.331708  1
  C  C256  1  0.445753  0.249036  0.331708  1
  C  C257  1  0.421687  0.727211  0.365623  1
  C  C258  1  0.921687  0.227211  0.365623  1
  C  C259  1  0.838268  0.643934  0.490820  1
  C  C260  1  0.338268  0.143934  0.490820  1
  C  C261  1  0.345872  0.279270  0.388603  1
  C  C262  1  0.845872  0.779270  0.388603  1
  C  C263  1  0.933737  0.370396  0.268960  1
  C  C264  1  0.433737  0.870396  0.268960  1
  C  C265  1  0.261281  0.587688  0.491181  1
  C  C266  1  0.761281  0.087688  0.491181  1
  C  C267  1  0.844875  0.671468  0.366375  1
  C  C268  1  0.344875  0.171468  0.366375  1
  C  C269  1  0.346352  0.607776  0.281722  1
  C  C270  1  0.846352  0.107776  0.281722  1
  C  C271  1  0.766281  0.525056  0.407838  1
  C  C272  1  0.266281  0.025056  0.407838  1
  C  C273  1  0.321604  0.607541  0.257558  1
  C  C274  1  0.821603  0.107541  0.257558  1
  C  C275  1  0.741631  0.516010  0.383223  1
  C  C276  1  0.241631  0.016010  0.383223  1
  C  C277  1  0.324915  0.631537  0.333241  1
  C  C278  1  0.824915  0.131537  0.333241  1
  C  C279  1  0.742832  0.548534  0.457836  1
  C  C280  1  0.242832  0.048534  0.457836  1
  C  C281  1  0.416163  0.734735  0.271044  1
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  C  C1785  1  0.062173  0.444947  0.699053  1
  C  C1786  1  0.562173  0.944948  0.699051  1
  C  C1787  1  0.643225  0.525827  0.568209  1
  C  C1788  1  0.143225  0.025827  0.568209  1
  C  C1789  1  0.084944  0.309250  0.619534  1
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  C  C1791  1  0.504971  0.217719  0.745200  1
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  C  C1793  1  0.351865  0.342054  0.532435  1
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  C  C1795  1  0.768332  0.258187  0.656947  1
  C  C1796  1  0.268332  0.758187  0.656947  1
  C  C1797  1  0.197370  0.196462  0.695648  1
  C  C1798  1  0.697370  0.696462  0.695648  1
  C  C1799  1  0.775708  0.284723  0.569574  1
  C  C1800  1  0.275708  0.784723  0.569574  1
  C  C1801  1  0.111633  0.370606  0.641056  1
  C  C1802  1  0.611633  0.870606  0.641056  1
  C  C1803  1  0.695053  0.453883  0.515860  1
  C  C1804  1  0.195053  0.953883  0.515860  1
  C  C1805  1  0.165586  0.309415  0.709877  1
  C  C1806  1  0.665586  0.809415  0.709877  1
  C  C1807  1  0.750830  0.397736  0.583930  1
  C  C1808  1  0.250830  0.897736  0.583930  1
  C  C1809  1  0.335186  0.426168  0.557775  1
  C  C1810  1  0.835186  0.926168  0.557775  1
  C  C1811  1  0.751579  0.342188  0.682462  1
  C  C1812  1  0.251579  0.842188  0.682462  1
  C  C1813  1  0.076570  0.351156  0.632233  1
  C  C1814  1  0.576570  0.851156  0.632233  1
  C  C1815  1  0.659989  0.434433  0.507037  1
  C  C1816  1  0.159989  0.934433  0.507037  1
  C  C1817  1  0.183801  0.240663  0.689467  1
  C  C1818  1  0.683801  0.740663  0.689467  1
  C  C1819  1  0.764417  0.329599  0.563236  1
  C  C1820  1  0.264417  0.829599  0.563236  1
  C  C1821  1  0.130646  0.263513  0.588540  1
  C  C1822  1  0.630646  0.763513  0.588540  1
  C  C1823  1  0.548981  0.178052  0.712033  1
  C  C1824  1  0.048981  0.678052  0.712034  1
  C  C1825  1  0.080321  0.176755  0.663461  1
  C  C1826  1  0.580321  0.676755  0.663461  1
  C  C1827  1  0.663970  0.260596  0.538515  1
  C  C1828  1  0.163970  0.760596  0.538515  1
  C  C1829  1  0.364731  0.205409  0.512363  1
  C  C1830  1  0.864731  0.705409  0.512363  1
  C  C1831  1  0.781132  0.123189  0.637165  1
  C  C1832  1  0.281132  0.623189  0.637165  1
  C  C1833  1  0.258573  0.244405  0.676421  1
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  C  C1837  1  0.325417  0.232061  0.557547  1
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  C  C1839  1  0.742144  0.149323  0.682804  1
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  C  C1841  1  0.100235  0.415708  0.634661  1
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  C  C1843  1  0.683656  0.498984  0.509462  1
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  C  C1855  1  0.617957  0.217960  0.731432  1
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  C  C1857  1  0.153034  0.267855  0.708215  1
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  C  C1859  1  0.736165  0.357864  0.582390  1
  C  C1860  1  0.236165  0.857864  0.582390  1
  C  C1861  1  0.167737  0.259922  0.570407  1
  C  C1862  1  0.667737  0.759922  0.570407  1
  C  C1863  1  0.585884  0.175710  0.694148  1
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  C  C1865  1  0.224175  0.366744  0.532056  1
  C  C1866  1  0.724175  0.866744  0.532056  1
  C  C1867  1  0.640151  0.284161  0.657490  1
  C  C1868  1  0.140151  0.784161  0.657490  1
  C  C1869  1  0.203594  0.307007  0.691949  1
  C  C1870  1  0.703594  0.807007  0.691949  1
  C  C1871  1  0.788144  0.394114  0.565728  1
  C  C1872  1  0.288144  0.894114  0.565728  1
  C  C1873  1  0.277994  0.471451  0.627978  1
  C  C1874  1  0.777994  0.971451  0.627978  1
  C  C1875  1  0.861003  0.553966  0.503578  1
  C  C1876  1  0.361003  0.053966  0.503578  1
  C  C1877  1  0.215216  0.342207  0.607640  1
  C  C1878  1  0.715216  0.842207  0.607640  1
  C  C1879  1  0.637832  0.252745  0.731593  1
  C  C1880  1  0.137832  0.752745  0.731594  1
  C  C1881  1  0.162915  0.264736  0.539402  1
  C  C1882  1  0.662915  0.764736  0.539402  1
  C  C1883  1  0.580611  0.181250  0.662866  1
  C  C1884  1  0.080611  0.681250  0.662866  1
  C  C1885  1  0.601135  0.534306  0.555407  1
  C  C1886  1  0.101135  0.034306  0.555407  1
  C  C1887  1  0.021894  0.449747  0.684212  1
  C  C1888  1  0.521894  0.949747  0.684211  1
  C  C1889  1  0.173993  0.116755  0.607050  1
  C  C1890  1  0.673993  0.616755  0.607050  1
  C  C1891  1  0.587981  0.040198  0.732791  1
  C  C1892  1  0.087980  0.540197  0.732790  1
  C  C1893  1  0.186970  0.370474  0.626796  1
  C  C1894  1  0.686970  0.870474  0.626796  1
  C  C1895  1  0.770390  0.453751  0.501599  1
  C  C1896  1  0.270390  0.953751  0.501599  1
  C  C1897  1  0.194998  0.287161  0.529064  1
  C  C1898  1  0.694998  0.787161  0.529064  1
  C  C1899  1  0.612162  0.204180  0.652939  1
  C  C1900  1  0.112162  0.704180  0.652939  1
  C  C1901  1  0.154887  0.348049  0.637134  1
  C  C1902  1  0.654887  0.848049  0.637134  1
  C  C1903  1  0.738307  0.431326  0.511937  1
  C  C1904  1  0.238307  0.931326  0.511937  1
  C  C1905  1  0.258956  0.156088  0.572784  1
  C  C1906  1  0.758956  0.656088  0.572784  1
  C  C1907  1  0.675648  0.074272  0.697522  1
  C  C1908  1  0.175648  0.574272  0.697522  1
  C  C1909  1  0.579146  0.481133  0.588749  1
  C  C1910  1  0.079146  0.981133  0.588749  1
  C  C1911  1  0.000620  0.395368  0.718536  1
  C  C1912  1  0.500620  0.895367  0.718537  1
  C  C1913  1  0.507571  0.188434  0.700131  1
  C  C1914  1  0.007571  0.688434  0.700131  1
  C  C1915  1  0.088539  0.271937  0.575764  1
  C  C1916  1  0.588539  0.771937  0.575764  1
  C  C1917  1  0.622087  0.268995  0.525799  1
  C  C1918  1  0.122087  0.768995  0.525799  1
  C  C1919  1  0.038452  0.185188  0.650724  1
  C  C1920  1  0.538452  0.685188  0.650724  1
