# generated using pymatgen
data_Li2MnH8(SO6)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.29974428
_cell_length_b   11.90192211
_cell_length_c   12.57777545
_cell_angle_alpha   61.84933273
_cell_angle_beta   90.00000000
_cell_angle_gamma   112.99696806
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2MnH8(SO6)2
_chemical_formula_sum   'Li8 Mn4 H32 S8 O48'
_cell_volume   1100.41227987
_cell_formula_units_Z   4
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
  Li  Li0  1  0.00637592  0.24874991  0.30936158  1
  Li  Li1  1  0.62541179  0.27122426  0.34065238  1
  Li  Li2  1  0.35418652  0.72877574  0.15934762  1
  Li  Li3  1  0.75762701  0.75125009  0.19063842  1
  Li  Li4  1  0.24237299  0.24874991  0.80936158  1
  Li  Li5  1  0.64581348  0.27122426  0.84065238  1
  Li  Li6  1  0.37458821  0.72877574  0.65934762  1
  Li  Li7  1  0.99362408  0.75125009  0.69063842  1
  Mn  Mn8  1  -0.00000000  0.50000000  0.00000000  1
  Mn  Mn9  1  0.25025663  1.00000000  0.25000000  1
  Mn  Mn10  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn11  1  0.74974337  0.00000000  0.75000000  1
  H  H12  1  0.01141173  0.25140758  0.04132575  1
  H  H13  1  0.72819958  0.25658818  0.05294358  1
  H  H14  1  0.35976770  0.28212372  0.04406706  1
  H  H15  1  0.97255915  0.03118258  0.17566325  1
  H  H16  1  0.55676139  0.03242023  0.17536504  1
  H  H17  1  0.81505431  0.62820492  0.00995712  1
  H  H18  1  0.31475643  0.61680774  0.00713278  1
  H  H19  1  0.40471489  0.29137087  0.16438955  1
  H  H20  1  0.11334403  0.70862913  0.33561045  1
  H  H21  1  0.69794869  0.38319226  0.49286722  1
  H  H22  1  0.23999585  0.25140758  0.54132575  1
  H  H23  1  0.18684939  0.37179508  0.49004288  1
  H  H24  1  0.52838860  0.25658818  0.55294358  1
  H  H25  1  0.92235602  0.28212372  0.54406706  1
  H  H26  1  0.05862343  0.03118258  0.67566325  1
  H  H27  1  0.47565884  0.03242023  0.67536504  1
  H  H28  1  0.52434116  0.96757977  0.32463496  1
  H  H29  1  0.94137657  0.96881742  0.32433675  1
  H  H30  1  0.07764398  0.71787628  0.45593294  1
  H  H31  1  0.47161140  0.74341182  0.44705642  1
  H  H32  1  0.81315061  0.62820492  0.50995712  1
  H  H33  1  0.76000415  0.74859242  0.45867425  1
  H  H34  1  0.30205131  0.61680774  0.50713278  1
  H  H35  1  0.88665597  0.29137087  0.66438955  1
  H  H36  1  0.59528511  0.70862913  0.83561045  1
  H  H37  1  0.68524357  0.38319226  0.99286722  1
  H  H38  1  0.18494569  0.37179508  0.99004288  1
  H  H39  1  0.44323861  0.96757977  0.82463496  1
  H  H40  1  0.02744085  0.96881742  0.82433675  1
  H  H41  1  0.64023230  0.71787628  0.95593294  1
  H  H42  1  0.27180042  0.74341182  0.94705642  1
  H  H43  1  0.98858827  0.74859242  0.95867425  1
  S  S44  1  0.75727946  0.03695373  0.01948035  1
  S  S45  1  0.52467536  0.53307774  0.20329041  1
  S  S46  1  0.99159761  0.46692226  0.29670959  1
  S  S47  1  0.27967426  0.03695373  0.51948035  1
  S  S48  1  0.72032674  0.96304627  0.48051965  1
  S  S49  1  0.00840239  0.53307774  0.70329041  1
  S  S50  1  0.47532464  0.46692226  0.79670959  1
  S  S51  1  0.24272054  0.96304627  0.98051965  1
  O  O52  1  0.92201062  0.10211022  0.03761895  1
  O  O53  1  0.66915914  0.12146188  0.01583254  1
  O  O54  1  0.08227160  0.33790902  0.04431333  1
  O  O55  1  0.74859274  0.34607995  0.05076530  1
  O  O56  1  0.37580340  0.23010820  0.12828301  1
  O  O57  1  0.01791828  0.00000000  0.25000000  1
  O  O58  1  0.48142941  1.00000000  0.25000000  1
  O  O59  1  0.67484679  0.63409511  0.10085600  1
  O  O60  1  0.99518635  0.43231548  0.19671924  1
  O  O61  1  0.38902490  0.56443730  0.15912438  1
  O  O62  1  0.48971537  0.38378058  0.24723530  1
  O  O63  1  0.27176753  0.04035494  0.40119544  1
  O  O64  1  0.78016069  0.11181503  0.37394386  1
  O  O65  1  0.66834566  0.88818497  0.12605614  1
  O  O66  1  0.23141259  0.95964506  0.09880456  1
  O  O67  1  0.10593480  0.61621942  0.25276470  1
  O  O68  1  0.82458760  0.43556270  0.34087562  1
  O  O69  1  0.56287188  0.56768452  0.30328076  1
  O  O70  1  0.04075169  0.36590489  0.39914400  1
  O  O71  1  0.18009960  0.10211022  0.53761895  1
  O  O72  1  0.45230374  0.12146188  0.51583254  1
  O  O73  1  0.25563742  0.33790902  0.54431333  1
  O  O74  1  0.59748721  0.34607995  0.55076530  1
  O  O75  1  0.14569619  0.76989180  0.37171699  1
  O  O76  1  0.85430381  0.23010820  0.62828301  1
  O  O77  1  0.40251279  0.65392005  0.44923470  1
  O  O78  1  0.74436258  0.66209098  0.45568667  1
  O  O79  1  0.98208172  1.00000000  0.75000000  1
  O  O80  1  0.51857059  0.00000000  0.75000000  1
  O  O81  1  0.54769626  0.87853812  0.48416746  1
  O  O82  1  0.81990040  0.89788978  0.46238105  1
  O  O83  1  0.95924831  0.63409511  0.60085600  1
  O  O84  1  0.43712812  0.43231548  0.69671924  1
  O  O85  1  0.17541240  0.56443730  0.65912438  1
  O  O86  1  0.89406520  0.38378058  0.74723530  1
  O  O87  1  0.76858741  0.04035494  0.90119544  1
  O  O88  1  0.33165434  0.11181503  0.87394386  1
  O  O89  1  0.21983931  0.88818497  0.62605614  1
  O  O90  1  0.72823247  0.95964506  0.59880456  1
  O  O91  1  0.51028463  0.61621942  0.75276470  1
  O  O92  1  0.61097510  0.43556270  0.84087562  1
  O  O93  1  0.00481365  0.56768452  0.80328076  1
  O  O94  1  0.32515321  0.36590489  0.89914400  1
  O  O95  1  0.62419660  0.76989180  0.87171699  1
  O  O96  1  0.25140726  0.65392005  0.94923470  1
  O  O97  1  0.91772840  0.66209098  0.95568667  1
  O  O98  1  0.33084086  0.87853812  0.98416746  1
  O  O99  1  0.07798938  0.89788978  0.96238105  1
