# generated using pymatgen
data_Li2Cu2(SO4)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.64649600
_cell_length_b   8.68090300
_cell_length_c   24.13149000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2Cu2(SO4)3
_chemical_formula_sum   'Li16 Cu16 S24 O96'
_cell_volume   1811.29499318
_cell_formula_units_Z   8
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  0.03756200  0.62353200  0.29093100  1
  Li  Li1  1  0.03756200  0.87646800  0.79093100  1
  Li  Li2  1  0.14650200  0.93114200  0.00816900  1
  Li  Li3  1  0.14650200  0.56885800  0.50816900  1
  Li  Li4  1  0.35349800  0.06885800  0.50816900  1
  Li  Li5  1  0.35349800  0.43114200  0.00816900  1
  Li  Li6  1  0.46243800  0.12353200  0.29093100  1
  Li  Li7  1  0.46243800  0.37646800  0.79093100  1
  Li  Li8  1  0.53756200  0.62353200  0.20906900  1
  Li  Li9  1  0.53756200  0.87646800  0.70906900  1
  Li  Li10  1  0.64650200  0.56885800  0.99183100  1
  Li  Li11  1  0.64650200  0.93114200  0.49183100  1
  Li  Li12  1  0.85349800  0.43114200  0.49183100  1
  Li  Li13  1  0.85349800  0.06885800  0.99183100  1
  Li  Li14  1  0.96243800  0.12353200  0.20906900  1
  Li  Li15  1  0.96243800  0.37646800  0.70906900  1
  Cu  Cu16  1  0.00626500  0.40160400  0.06567400  1
  Cu  Cu17  1  0.00626500  0.09839600  0.56567400  1
  Cu  Cu18  1  0.99763000  0.79716900  0.17940400  1
  Cu  Cu19  1  0.99763000  0.70283100  0.67940400  1
  Cu  Cu20  1  0.50237000  0.29716900  0.17940400  1
  Cu  Cu21  1  0.50237000  0.20283100  0.67940400  1
  Cu  Cu22  1  0.49373500  0.59839600  0.56567400  1
  Cu  Cu23  1  0.49373500  0.90160400  0.06567400  1
  Cu  Cu24  1  0.50626500  0.40160400  0.43432600  1
  Cu  Cu25  1  0.50626500  0.09839600  0.93432600  1
  Cu  Cu26  1  0.49763000  0.70283100  0.82059600  1
  Cu  Cu27  1  0.49763000  0.79716900  0.32059600  1
  Cu  Cu28  1  0.00237000  0.29716900  0.32059600  1
  Cu  Cu29  1  0.00237000  0.20283100  0.82059600  1
  Cu  Cu30  1  0.99373500  0.90160400  0.43432600  1
  Cu  Cu31  1  0.99373500  0.59839600  0.93432600  1
  S  S32  1  0.14245500  0.94792800  0.29791100  1
  S  S33  1  0.14245500  0.55207200  0.79791100  1
  S  S34  1  0.14773900  0.25288100  0.44454000  1
  S  S35  1  0.14773900  0.24711900  0.94454000  1
  S  S36  1  0.19579700  0.09414900  0.11574600  1
  S  S37  1  0.19579700  0.40585100  0.61574600  1
  S  S38  1  0.30420300  0.59414900  0.11574600  1
  S  S39  1  0.30420300  0.90585100  0.61574600  1
  S  S40  1  0.35226100  0.75288100  0.44454000  1
  S  S41  1  0.35226100  0.74711900  0.94454000  1
  S  S42  1  0.35754500  0.44792800  0.29791100  1
  S  S43  1  0.35754500  0.05207200  0.79791100  1
  S  S44  1  0.64245500  0.55207200  0.70208900  1
  S  S45  1  0.64245500  0.94792800  0.20208900  1
  S  S46  1  0.64773900  0.25288100  0.05546000  1
  S  S47  1  0.64773900  0.24711900  0.55546000  1
  S  S48  1  0.69579700  0.09414900  0.38425400  1
  S  S49  1  0.69579700  0.40585100  0.88425400  1
  S  S50  1  0.80420300  0.59414900  0.38425400  1
  S  S51  1  0.80420300  0.90585100  0.88425400  1
  S  S52  1  0.85226100  0.75288100  0.05546000  1
  S  S53  1  0.85226100  0.74711900  0.55546000  1
  S  S54  1  0.85754500  0.44792800  0.20208900  1
  S  S55  1  0.85754500  0.05207200  0.70208900  1
  O  O56  1  0.06196000  0.38882600  0.46401200  1
  O  O57  1  0.06196000  0.11117400  0.96401200  1
  O  O58  1  0.07997500  0.09837800  0.27775300  1
  O  O59  1  0.07997500  0.40162200  0.77775300  1
  O  O60  1  0.08479100  0.10585900  0.47105200  1
  O  O61  1  0.08479100  0.39414100  0.97105200  1
  O  O62  1  0.08558400  0.90798000  0.35326800  1
  O  O63  1  0.08558400  0.59202000  0.85326800  1
  O  O64  1  0.09309400  0.18932800  0.08025300  1
  O  O65  1  0.09309400  0.31067200  0.58025300  1
  O  O66  1  0.09074400  0.82285000  0.25897800  1
  O  O67  1  0.09074400  0.67715000  0.75897800  1
  O  O68  1  0.09659300  0.00855600  0.15643000  1
  O  O69  1  0.09659300  0.49144400  0.65643000  1
  O  O70  1  0.13959400  0.23581700  0.38371100  1
  O  O71  1  0.13959400  0.26418300  0.88371100  1
  O  O72  1  0.18556800  0.45794500  0.29582700  1
  O  O73  1  0.18556800  0.04205500  0.79582700  1
  O  O74  1  0.19028000  0.68383200  0.14670100  1
  O  O75  1  0.19028000  0.81616800  0.64670100  1
  O  O76  1  0.18729500  0.76368300  0.46302200  1
  O  O77  1  0.18729500  0.73631700  0.96302200  1
  O  O78  1  0.22786400  0.01743900  0.57623400  1
  O  O79  1  0.22786400  0.48256100  0.07623400  1
  O  O80  1  0.27213600  0.98256100  0.07623400  1
  O  O81  1  0.27213600  0.51743900  0.57623400  1
  O  O82  1  0.31270500  0.23631700  0.96302200  1
  O  O83  1  0.31270500  0.26368300  0.46302200  1
  O  O84  1  0.30972000  0.18383200  0.14670100  1
  O  O85  1  0.30972000  0.31616800  0.64670100  1
  O  O86  1  0.31443200  0.95794500  0.29582700  1
  O  O87  1  0.31443200  0.54205500  0.79582700  1
  O  O88  1  0.36040600  0.73581700  0.38371100  1
  O  O89  1  0.36040600  0.76418300  0.88371100  1
  O  O90  1  0.40340700  0.99144400  0.65643000  1
  O  O91  1  0.40340700  0.50855600  0.15643000  1
  O  O92  1  0.40925600  0.32285000  0.25897800  1
  O  O93  1  0.40925600  0.17715000  0.75897800  1
  O  O94  1  0.40690600  0.68932800  0.08025300  1
  O  O95  1  0.40690600  0.81067200  0.58025300  1
  O  O96  1  0.41441600  0.09202000  0.85326800  1
  O  O97  1  0.41441600  0.40798000  0.35326800  1
  O  O98  1  0.41520900  0.89414100  0.97105200  1
  O  O99  1  0.41520900  0.60585900  0.47105200  1
  O  O100  1  0.42002500  0.59837800  0.27775300  1
  O  O101  1  0.42002500  0.90162200  0.77775300  1
  O  O102  1  0.43804000  0.61117400  0.96401200  1
  O  O103  1  0.43804000  0.88882600  0.46401200  1
  O  O104  1  0.56196000  0.38882600  0.03598800  1
  O  O105  1  0.56196000  0.11117400  0.53598800  1
  O  O106  1  0.57997500  0.09837800  0.22224700  1
  O  O107  1  0.57997500  0.40162200  0.72224700  1
  O  O108  1  0.58479100  0.10585900  0.02894800  1
  O  O109  1  0.58479100  0.39414100  0.52894800  1
  O  O110  1  0.58558400  0.59202000  0.64673200  1
  O  O111  1  0.58558400  0.90798000  0.14673200  1
  O  O112  1  0.59309400  0.18932800  0.41974700  1
  O  O113  1  0.59309400  0.31067200  0.91974700  1
  O  O114  1  0.59074400  0.82285000  0.24102200  1
  O  O115  1  0.59074400  0.67715000  0.74102200  1
  O  O116  1  0.59659300  0.00855600  0.34357000  1
  O  O117  1  0.59659300  0.49144400  0.84357000  1
  O  O118  1  0.63959400  0.23581700  0.11628900  1
  O  O119  1  0.63959400  0.26418300  0.61628900  1
  O  O120  1  0.68556800  0.45794500  0.20417300  1
  O  O121  1  0.68556800  0.04205500  0.70417300  1
  O  O122  1  0.69028000  0.68383200  0.35329900  1
  O  O123  1  0.69028000  0.81616800  0.85329900  1
  O  O124  1  0.68729500  0.76368300  0.03697800  1
  O  O125  1  0.68729500  0.73631700  0.53697800  1
  O  O126  1  0.72786400  0.48256100  0.42376600  1
  O  O127  1  0.72786400  0.01743900  0.92376600  1
  O  O128  1  0.77213600  0.98256100  0.42376600  1
  O  O129  1  0.77213600  0.51743900  0.92376600  1
  O  O130  1  0.81270500  0.26368300  0.03697800  1
  O  O131  1  0.81270500  0.23631700  0.53697800  1
  O  O132  1  0.80972000  0.18383200  0.35329900  1
  O  O133  1  0.80972000  0.31616800  0.85329900  1
  O  O134  1  0.81443200  0.54205500  0.70417300  1
  O  O135  1  0.81443200  0.95794500  0.20417300  1
  O  O136  1  0.86040600  0.73581700  0.11628900  1
  O  O137  1  0.86040600  0.76418300  0.61628900  1
  O  O138  1  0.90340700  0.50855600  0.34357000  1
  O  O139  1  0.90340700  0.99144400  0.84357000  1
  O  O140  1  0.90925600  0.32285000  0.24102200  1
  O  O141  1  0.90925600  0.17715000  0.74102200  1
  O  O142  1  0.90690600  0.68932800  0.41974700  1
  O  O143  1  0.90690600  0.81067200  0.91974700  1
  O  O144  1  0.91441600  0.40798000  0.14673200  1
  O  O145  1  0.91441600  0.09202000  0.64673200  1
  O  O146  1  0.91520900  0.60585900  0.02894800  1
  O  O147  1  0.91520900  0.89414100  0.52894800  1
  O  O148  1  0.92002500  0.59837800  0.22224700  1
  O  O149  1  0.92002500  0.90162200  0.72224700  1
  O  O150  1  0.93804000  0.61117400  0.53598800  1
  O  O151  1  0.93804000  0.88882600  0.03598800  1
