# generated using pymatgen
data_Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   15.74873110
_cell_length_b   15.74873110
_cell_length_c   15.74873110
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mo
_chemical_formula_sum   Mo249
_cell_volume   3906.04015426
_cell_formula_units_Z   249
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
  Mo  Mo1  1  0.100065  0.100065  0.303977  1
  Mo  Mo2  1  0.100065  0.100065  0.500680  1
  Mo  Mo3  1  0.100065  0.100065  0.699449  1
  Mo  Mo4  1  0.100065  0.100065  0.896152  1
  Mo  Mo5  1  0.100065  0.303977  0.100065  1
  Mo  Mo6  1  0.100065  0.299655  0.299655  1
  Mo  Mo7  1  0.100065  0.300021  0.499984  1
  Mo  Mo8  1  0.100065  0.300021  0.700145  1
  Mo  Mo9  1  0.100065  0.299655  0.900474  1
  Mo  Mo10  1  0.100065  0.500680  0.100065  1
  Mo  Mo11  1  0.100065  0.499984  0.300021  1
  Mo  Mo12  1  0.100065  0.500045  0.500045  1
  Mo  Mo13  1  0.100065  0.500045  0.700085  1
  Mo  Mo14  1  0.100065  0.499984  0.900109  1
  Mo  Mo15  1  0.100065  0.699449  0.100065  1
  Mo  Mo16  1  0.100065  0.700145  0.300021  1
  Mo  Mo17  1  0.100065  0.700085  0.500045  1
  Mo  Mo18  1  0.100065  0.700085  0.700085  1
  Mo  Mo19  1  0.100065  0.700145  0.900109  1
  Mo  Mo20  1  0.100065  0.896152  0.100065  1
  Mo  Mo21  1  0.100065  0.900474  0.299655  1
  Mo  Mo22  1  0.100065  0.900109  0.499984  1
  Mo  Mo23  1  0.100065  0.900109  0.700145  1
  Mo  Mo24  1  0.100065  0.900474  0.900474  1
  Mo  Mo25  1  0.303977  0.100065  0.100065  1
  Mo  Mo26  1  0.299655  0.100065  0.299655  1
  Mo  Mo27  1  0.300021  0.100065  0.499984  1
  Mo  Mo28  1  0.300021  0.100065  0.700145  1
  Mo  Mo29  1  0.299655  0.100065  0.900474  1
  Mo  Mo30  1  0.299655  0.299655  0.100065  1
  Mo  Mo31  1  0.299586  0.299586  0.299586  1
  Mo  Mo32  1  0.300075  0.300075  0.499979  1
  Mo  Mo33  1  0.300075  0.300075  0.700150  1
  Mo  Mo34  1  0.299586  0.299586  0.900544  1
  Mo  Mo35  1  0.300021  0.499984  0.100065  1
  Mo  Mo36  1  0.300075  0.499979  0.300075  1
  Mo  Mo37  1  0.300054  0.500048  0.500048  1
  Mo  Mo38  1  0.300054  0.500048  0.700081  1
  Mo  Mo39  1  0.300075  0.499979  0.900055  1
  Mo  Mo40  1  0.300021  0.700145  0.100065  1
  Mo  Mo41  1  0.300075  0.700150  0.300075  1
  Mo  Mo42  1  0.300054  0.700081  0.500048  1
  Mo  Mo43  1  0.300054  0.700081  0.700081  1
  Mo  Mo44  1  0.300075  0.700150  0.900055  1
  Mo  Mo45  1  0.299655  0.900474  0.100065  1
  Mo  Mo46  1  0.299586  0.900544  0.299586  1
  Mo  Mo47  1  0.300075  0.900055  0.499979  1
  Mo  Mo48  1  0.300075  0.900055  0.700150  1
  Mo  Mo49  1  0.299586  0.900544  0.900544  1
  Mo  Mo50  1  0.500680  0.100065  0.100065  1
  Mo  Mo51  1  0.499984  0.100065  0.300021  1
  Mo  Mo52  1  0.500045  0.100065  0.500045  1
  Mo  Mo53  1  0.500045  0.100065  0.700085  1
  Mo  Mo54  1  0.499984  0.100065  0.900109  1
  Mo  Mo55  1  0.499984  0.300021  0.100065  1
  Mo  Mo56  1  0.499979  0.300075  0.300075  1
  Mo  Mo57  1  0.500048  0.300054  0.500048  1
  Mo  Mo58  1  0.500048  0.300054  0.700081  1
  Mo  Mo59  1  0.499979  0.300075  0.900055  1
  Mo  Mo60  1  0.500045  0.500045  0.100065  1
  Mo  Mo61  1  0.500048  0.500048  0.300054  1
  Mo  Mo62  1  0.500039  0.500039  0.500039  1
  Mo  Mo63  1  0.500039  0.500039  0.700090  1
  Mo  Mo64  1  0.500048  0.500048  0.900075  1
  Mo  Mo65  1  0.500045  0.700085  0.100065  1
  Mo  Mo66  1  0.500048  0.700081  0.300054  1
  Mo  Mo67  1  0.500039  0.700090  0.500039  1
  Mo  Mo68  1  0.500039  0.700090  0.700090  1
  Mo  Mo69  1  0.500048  0.700081  0.900075  1
  Mo  Mo70  1  0.499984  0.900109  0.100065  1
  Mo  Mo71  1  0.499979  0.900055  0.300075  1
  Mo  Mo72  1  0.500048  0.900075  0.500048  1
  Mo  Mo73  1  0.500048  0.900075  0.700081  1
  Mo  Mo74  1  0.499979  0.900055  0.900055  1
  Mo  Mo75  1  0.699449  0.100065  0.100065  1
  Mo  Mo76  1  0.700145  0.100065  0.300021  1
  Mo  Mo77  1  0.700085  0.100065  0.500045  1
  Mo  Mo78  1  0.700085  0.100065  0.700085  1
  Mo  Mo79  1  0.700145  0.100065  0.900109  1
  Mo  Mo80  1  0.700145  0.300021  0.100065  1
  Mo  Mo81  1  0.700150  0.300075  0.300075  1
  Mo  Mo82  1  0.700081  0.300054  0.500048  1
  Mo  Mo83  1  0.700081  0.300054  0.700081  1
  Mo  Mo84  1  0.700150  0.300075  0.900055  1
  Mo  Mo85  1  0.700085  0.500045  0.100065  1
  Mo  Mo86  1  0.700081  0.500048  0.300054  1
  Mo  Mo87  1  0.700090  0.500039  0.500039  1
  Mo  Mo88  1  0.700090  0.500039  0.700090  1
  Mo  Mo89  1  0.700081  0.500048  0.900075  1
  Mo  Mo90  1  0.700085  0.700085  0.100065  1
  Mo  Mo91  1  0.700081  0.700081  0.300054  1
  Mo  Mo92  1  0.700090  0.700090  0.500039  1
  Mo  Mo93  1  0.700090  0.700090  0.700090  1
  Mo  Mo94  1  0.700081  0.700081  0.900075  1
  Mo  Mo95  1  0.700145  0.900109  0.100065  1
  Mo  Mo96  1  0.700150  0.900055  0.300075  1
  Mo  Mo97  1  0.700081  0.900075  0.500048  1
  Mo  Mo98  1  0.700081  0.900075  0.700081  1
  Mo  Mo99  1  0.700150  0.900055  0.900055  1
  Mo  Mo100  1  0.896152  0.100065  0.100065  1
  Mo  Mo101  1  0.900474  0.100065  0.299655  1
  Mo  Mo102  1  0.900109  0.100065  0.499984  1
  Mo  Mo103  1  0.900109  0.100065  0.700145  1
  Mo  Mo104  1  0.900474  0.100065  0.900474  1
  Mo  Mo105  1  0.900474  0.299655  0.100065  1
  Mo  Mo106  1  0.900544  0.299586  0.299586  1
  Mo  Mo107  1  0.900055  0.300075  0.499979  1
  Mo  Mo108  1  0.900055  0.300075  0.700150  1
  Mo  Mo109  1  0.900544  0.299586  0.900544  1
  Mo  Mo110  1  0.900109  0.499984  0.100065  1
  Mo  Mo111  1  0.900055  0.499979  0.300075  1
  Mo  Mo112  1  0.900075  0.500048  0.500048  1
  Mo  Mo113  1  0.900075  0.500048  0.700081  1
  Mo  Mo114  1  0.900055  0.499979  0.900055  1
  Mo  Mo115  1  0.900109  0.700145  0.100065  1
  Mo  Mo116  1  0.900055  0.700150  0.300075  1
  Mo  Mo117  1  0.900075  0.700081  0.500048  1
  Mo  Mo118  1  0.900075  0.700081  0.700081  1
  Mo  Mo119  1  0.900055  0.700150  0.900055  1
  Mo  Mo120  1  0.900474  0.900474  0.100065  1
  Mo  Mo121  1  0.900544  0.900544  0.299586  1
  Mo  Mo122  1  0.900055  0.900055  0.499979  1
  Mo  Mo123  1  0.900055  0.900055  0.700150  1
  Mo  Mo124  1  0.900544  0.900544  0.900544  1
  Mo  Mo125  1  0.001984  0.001984  0.001984  1
  Mo  Mo126  1  0.001984  0.001984  0.198145  1
  Mo  Mo127  1  0.999899  0.999899  0.399902  1
  Mo  Mo128  1  0.999964  0.999964  0.600065  1
  Mo  Mo129  1  0.999899  0.999899  0.800227  1
  Mo  Mo130  1  0.001984  0.198145  0.001984  1
  Mo  Mo131  1  0.001984  0.198145  0.198145  1
  Mo  Mo132  1  0.999899  0.200230  0.399902  1
  Mo  Mo133  1  0.999964  0.200166  0.600065  1
  Mo  Mo134  1  0.999899  0.200230  0.800227  1
  Mo  Mo135  1  0.999899  0.399902  0.999899  1
  Mo  Mo136  1  0.999899  0.399902  0.200230  1
  Mo  Mo137  1  0.000104  0.400001  0.400001  1
  Mo  Mo138  1  0.000075  0.400051  0.600065  1
  Mo  Mo139  1  0.000104  0.400001  0.800128  1
  Mo  Mo140  1  0.999964  0.600065  0.999964  1
  Mo  Mo141  1  0.999964  0.600065  0.200166  1
  Mo  Mo142  1  0.000075  0.600065  0.400051  1
  Mo  Mo143  1  0.000070  0.600065  0.600065  1
  Mo  Mo144  1  0.000075  0.600065  0.800078  1
  Mo  Mo145  1  0.999899  0.800227  0.999899  1
  Mo  Mo146  1  0.999899  0.800227  0.200230  1
  Mo  Mo147  1  0.000104  0.800128  0.400001  1
  Mo  Mo148  1  0.000075  0.800078  0.600065  1
  Mo  Mo149  1  0.000104  0.800128  0.800128  1
  Mo  Mo150  1  0.198145  0.001984  0.001984  1
  Mo  Mo151  1  0.198145  0.001984  0.198145  1
  Mo  Mo152  1  0.200230  0.999899  0.399902  1
  Mo  Mo153  1  0.200166  0.999964  0.600065  1
  Mo  Mo154  1  0.200230  0.999899  0.800227  1
  Mo  Mo155  1  0.198145  0.198145  0.001984  1
  Mo  Mo156  1  0.198145  0.198145  0.198145  1
  Mo  Mo157  1  0.200230  0.200230  0.399902  1
  Mo  Mo158  1  0.200166  0.200166  0.600065  1
  Mo  Mo159  1  0.200230  0.200230  0.800227  1
  Mo  Mo160  1  0.200230  0.399902  0.999899  1
  Mo  Mo161  1  0.200230  0.399902  0.200230  1
  Mo  Mo162  1  0.200025  0.400001  0.400001  1
  Mo  Mo163  1  0.200054  0.400051  0.600065  1
  Mo  Mo164  1  0.200025  0.400001  0.800128  1
  Mo  Mo165  1  0.200166  0.600065  0.999964  1
  Mo  Mo166  1  0.200166  0.600065  0.200166  1
  Mo  Mo167  1  0.200054  0.600065  0.400051  1
  Mo  Mo168  1  0.200059  0.600065  0.600065  1
  Mo  Mo169  1  0.200054  0.600065  0.800078  1
  Mo  Mo170  1  0.200230  0.800227  0.999899  1
  Mo  Mo171  1  0.200230  0.800227  0.200230  1
  Mo  Mo172  1  0.200025  0.800128  0.400001  1
  Mo  Mo173  1  0.200054  0.800078  0.600065  1
  Mo  Mo174  1  0.200025  0.800128  0.800128  1
  Mo  Mo175  1  0.399902  0.999899  0.999899  1
  Mo  Mo176  1  0.399902  0.999899  0.200230  1
  Mo  Mo177  1  0.400001  0.000104  0.400001  1
  Mo  Mo178  1  0.400051  0.000075  0.600065  1
  Mo  Mo179  1  0.400001  0.000104  0.800128  1
  Mo  Mo180  1  0.399902  0.200230  0.999899  1
  Mo  Mo181  1  0.399902  0.200230  0.200230  1
  Mo  Mo182  1  0.400001  0.200025  0.400001  1
  Mo  Mo183  1  0.400051  0.200054  0.600065  1
  Mo  Mo184  1  0.400001  0.200025  0.800128  1
  Mo  Mo185  1  0.400001  0.400001  0.000104  1
  Mo  Mo186  1  0.400001  0.400001  0.200025  1
  Mo  Mo187  1  0.399949  0.399949  0.399949  1
  Mo  Mo188  1  0.400047  0.400047  0.600065  1
  Mo  Mo189  1  0.399949  0.399949  0.800180  1
  Mo  Mo190  1  0.400051  0.600065  0.000075  1
  Mo  Mo191  1  0.400051  0.600065  0.200054  1
  Mo  Mo192  1  0.400047  0.600065  0.400047  1
  Mo  Mo193  1  0.400060  0.600065  0.600065  1
  Mo  Mo194  1  0.400047  0.600065  0.800083  1
  Mo  Mo195  1  0.400001  0.800128  0.000104  1
  Mo  Mo196  1  0.400001  0.800128  0.200025  1
  Mo  Mo197  1  0.399949  0.800180  0.399949  1
  Mo  Mo198  1  0.400047  0.800083  0.600065  1
  Mo  Mo199  1  0.399949  0.800180  0.800180  1
  Mo  Mo200  1  0.600065  0.999964  0.999964  1
  Mo  Mo201  1  0.600065  0.999964  0.200166  1
  Mo  Mo202  1  0.600065  0.000075  0.400051  1
  Mo  Mo203  1  0.600065  0.000070  0.600065  1
  Mo  Mo204  1  0.600065  0.000075  0.800078  1
  Mo  Mo205  1  0.600065  0.200166  0.999964  1
  Mo  Mo206  1  0.600065  0.200166  0.200166  1
  Mo  Mo207  1  0.600065  0.200054  0.400051  1
  Mo  Mo208  1  0.600065  0.200059  0.600065  1
  Mo  Mo209  1  0.600065  0.200054  0.800078  1
  Mo  Mo210  1  0.600065  0.400051  0.000075  1
  Mo  Mo211  1  0.600065  0.400051  0.200054  1
  Mo  Mo212  1  0.600065  0.400047  0.400047  1
  Mo  Mo213  1  0.600065  0.400060  0.600065  1
  Mo  Mo214  1  0.600065  0.400047  0.800083  1
  Mo  Mo215  1  0.600065  0.600065  0.000070  1
  Mo  Mo216  1  0.600065  0.600065  0.200059  1
  Mo  Mo217  1  0.600065  0.600065  0.400060  1
  Mo  Mo218  1  0.600065  0.600065  0.600065  1
  Mo  Mo219  1  0.600065  0.600065  0.800069  1
  Mo  Mo220  1  0.600065  0.800078  0.000075  1
  Mo  Mo221  1  0.600065  0.800078  0.200054  1
  Mo  Mo222  1  0.600065  0.800083  0.400047  1
  Mo  Mo223  1  0.600065  0.800069  0.600065  1
  Mo  Mo224  1  0.600065  0.800083  0.800083  1
  Mo  Mo225  1  0.800227  0.999899  0.999899  1
  Mo  Mo226  1  0.800227  0.999899  0.200230  1
  Mo  Mo227  1  0.800128  0.000104  0.400001  1
  Mo  Mo228  1  0.800078  0.000075  0.600065  1
  Mo  Mo229  1  0.800128  0.000104  0.800128  1
  Mo  Mo230  1  0.800227  0.200230  0.999899  1
  Mo  Mo231  1  0.800227  0.200230  0.200230  1
  Mo  Mo232  1  0.800128  0.200025  0.400001  1
  Mo  Mo233  1  0.800078  0.200054  0.600065  1
  Mo  Mo234  1  0.800128  0.200025  0.800128  1
  Mo  Mo235  1  0.800128  0.400001  0.000104  1
  Mo  Mo236  1  0.800128  0.400001  0.200025  1
  Mo  Mo237  1  0.800180  0.399949  0.399949  1
  Mo  Mo238  1  0.800083  0.400047  0.600065  1
  Mo  Mo239  1  0.800180  0.399949  0.800180  1
  Mo  Mo240  1  0.800078  0.600065  0.000075  1
  Mo  Mo241  1  0.800078  0.600065  0.200054  1
  Mo  Mo242  1  0.800083  0.600065  0.400047  1
  Mo  Mo243  1  0.800069  0.600065  0.600065  1
  Mo  Mo244  1  0.800083  0.600065  0.800083  1
  Mo  Mo245  1  0.800128  0.800128  0.000104  1
  Mo  Mo246  1  0.800128  0.800128  0.200025  1
  Mo  Mo247  1  0.800180  0.800180  0.399949  1
  Mo  Mo248  1  0.800083  0.800083  0.600065  1
  Mo  Mo249  1  0.800180  0.800180  0.800180  1
