# generated using pymatgen
data_Ba2Li3(PO3)7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.71383000
_cell_length_b   11.79190100
_cell_length_c   18.25136198
_cell_angle_alpha   75.58155795
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba2Li3(PO3)7
_chemical_formula_sum   'Ba8 Li12 P28 O84'
_cell_volume   1816.30669964
_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
  Ba  Ba0  1  0.44412900  0.52741000  0.81861600  1
  Ba  Ba1  1  0.05587100  0.52741000  0.31861600  1
  Ba  Ba2  1  0.55587100  0.47259000  0.18138400  1
  Ba  Ba3  1  0.06837600  0.96544400  0.19623400  1
  Ba  Ba4  1  0.43162400  0.96544400  0.69623400  1
  Ba  Ba5  1  0.93162400  0.03455600  0.80376600  1
  Ba  Ba6  1  0.94412900  0.47259000  0.68138400  1
  Ba  Ba7  1  0.56837600  0.03455600  0.30376600  1
  Li  Li8  1  0.35341300  0.48415600  0.46499100  1
  Li  Li9  1  0.86464700  0.99875600  0.45532100  1
  Li  Li10  1  0.64658700  0.51584400  0.53500900  1
  Li  Li11  1  0.63535300  0.99875600  0.95532100  1
  Li  Li12  1  0.85341300  0.51584400  0.03500900  1
  Li  Li13  1  0.14658700  0.48415600  0.96499100  1
  Li  Li14  1  0.13535300  0.00124400  0.54467900  1
  Li  Li15  1  0.22545900  0.63565500  0.15468900  1
  Li  Li16  1  0.36464700  0.00124400  0.04467900  1
  Li  Li17  1  0.72545900  0.36434500  0.34531100  1
  Li  Li18  1  0.77454100  0.36434500  0.84531100  1
  Li  Li19  1  0.27454100  0.63565500  0.65468900  1
  P  P20  1  0.94026200  0.24621400  0.25560600  1
  P  P21  1  0.16369600  0.11785000  0.36220200  1
  P  P22  1  0.09692900  0.29555600  0.88638100  1
  P  P23  1  0.87921900  0.15729000  0.99901100  1
  P  P24  1  0.89393300  0.78275500  0.38606700  1
  P  P25  1  0.05973800  0.75378600  0.74439400  1
  P  P26  1  0.63665100  0.33101800  0.00884100  1
  P  P27  1  0.60606700  0.78275500  0.88606700  1
  P  P28  1  0.33630400  0.11785000  0.86220200  1
  P  P29  1  0.85688500  0.61320400  0.86212600  1
  P  P30  1  0.12078100  0.84271000  0.00098900  1
  P  P31  1  0.62078100  0.15729000  0.49901100  1
  P  P32  1  0.36334900  0.66898200  0.99115900  1
  P  P33  1  0.59692900  0.70444400  0.61361900  1
  P  P34  1  0.39393300  0.21724500  0.11393300  1
  P  P35  1  0.83630400  0.88215000  0.63779800  1
  P  P36  1  0.66369600  0.88215000  0.13779800  1
  P  P37  1  0.13665100  0.66898200  0.49115900  1
  P  P38  1  0.40307100  0.29555600  0.38638100  1
  P  P39  1  0.55973800  0.24621400  0.75560600  1
  P  P40  1  0.64311500  0.61320400  0.36212600  1
  P  P41  1  0.90307100  0.70444400  0.11361900  1
  P  P42  1  0.37921900  0.84271000  0.50098900  1
  P  P43  1  0.86334900  0.33101800  0.50884100  1
  P  P44  1  0.35688500  0.38679600  0.63787400  1
  P  P45  1  0.44026200  0.75378600  0.24439400  1
  P  P46  1  0.10606700  0.21724500  0.61393300  1
  P  P47  1  0.14311500  0.38679600  0.13787400  1
  O  O48  1  0.68542900  0.82444600  0.61085800  1
  O  O49  1  0.36428600  0.86866800  0.24024900  1
  O  O50  1  0.15149700  0.64518700  0.74386500  1
  O  O51  1  0.48183400  0.25658400  0.03345600  1
  O  O52  1  0.70653500  0.60858600  0.60864600  1
  O  O53  1  0.21305800  0.05942800  0.30200000  1
  O  O54  1  0.20424100  0.44969700  0.19468600  1
  O  O55  1  0.51816600  0.74341600  0.96654400  1
  O  O56  1  0.15801600  0.57754300  0.44722300  1
  O  O57  1  0.86679100  0.37175700  0.42400800  1
  O  O58  1  0.19455400  0.10913200  0.61204500  1
  O  O59  1  0.29575900  0.44969700  0.69468600  1
  O  O60  1  0.31457100  0.17555400  0.38914200  1
  O  O61  1  0.18542900  0.17555400  0.88914200  1
  O  O62  1  0.06432900  0.23569600  0.32352200  1
  O  O63  1  0.98183400  0.74341600  0.46654400  1
  O  O64  1  0.84198400  0.42245700  0.55277700  1
  O  O65  1  0.51702300  0.31707100  0.32190300  1
  O  O66  1  0.80544600  0.89086800  0.38795500  1
  O  O67  1  0.36679100  0.62824300  0.07599200  1
  O  O68  1  0.01816600  0.25658400  0.53345600  1
  O  O69  1  0.30544600  0.10913200  0.11204500  1
  O  O70  1  0.69455400  0.89086800  0.88795500  1
  O  O71  1  0.95173400  0.72867600  0.81954100  1
  O  O72  1  0.34198400  0.57754300  0.94722300  1
  O  O73  1  0.91778500  0.94881700  0.56789300  1
  O  O74  1  0.00537900  0.26093700  0.96495200  1
  O  O75  1  0.50537900  0.73906300  0.53504800  1
  O  O76  1  0.34850300  0.64518700  0.24386500  1
  O  O77  1  0.98297700  0.31707100  0.82190300  1
  O  O78  1  0.71305800  0.94057200  0.19800000  1
  O  O79  1  0.63571400  0.13133200  0.75975100  1
  O  O80  1  0.29346500  0.39141400  0.39135400  1
  O  O81  1  0.79346500  0.60858600  0.10864600  1
  O  O82  1  0.58221500  0.94881700  0.06789300  1
  O  O83  1  0.56432900  0.76430400  0.17647800  1
  O  O84  1  0.45091100  0.93101400  0.43817900  1
  O  O85  1  0.49791700  0.22075800  0.17893400  1
  O  O86  1  0.04908900  0.93101400  0.93817900  1
  O  O87  1  0.20090800  0.87582900  0.06595200  1
  O  O88  1  0.50208300  0.77924200  0.82106600  1
  O  O89  1  0.29909200  0.87582900  0.56595200  1
  O  O90  1  0.81457100  0.82444600  0.11085800  1
  O  O91  1  0.08221500  0.05118300  0.43210700  1
  O  O92  1  0.63320900  0.37175700  0.92400800  1
  O  O93  1  0.23421200  0.76620400  0.96163400  1
  O  O94  1  0.28150800  0.33096300  0.10092100  1
  O  O95  1  0.70090800  0.12417100  0.43404800  1
  O  O96  1  0.01702300  0.68292900  0.17809700  1
  O  O97  1  0.76578800  0.23379600  0.03836600  1
  O  O98  1  0.54826600  0.72867600  0.31954100  1
  O  O99  1  0.86428600  0.13133200  0.25975100  1
  O  O100  1  0.28694200  0.05942800  0.80200000  1
  O  O101  1  0.78150800  0.66903700  0.39907900  1
  O  O102  1  0.99791700  0.77924200  0.32106600  1
  O  O103  1  0.65801600  0.42245700  0.05277700  1
  O  O104  1  0.04826600  0.27132400  0.18045900  1
  O  O105  1  0.26578800  0.76620400  0.46163400  1
  O  O106  1  0.44548600  0.45631400  0.57148500  1
  O  O107  1  0.00208300  0.22075800  0.67893400  1
  O  O108  1  0.95091100  0.06898600  0.06182100  1
  O  O109  1  0.55451400  0.54368600  0.42851500  1
  O  O110  1  0.78694200  0.94057200  0.69800000  1
  O  O111  1  0.05451400  0.45631400  0.07148500  1
  O  O112  1  0.94548600  0.54368600  0.92851500  1
  O  O113  1  0.54908900  0.06898600  0.56182100  1
  O  O114  1  0.45173400  0.27132400  0.68045900  1
  O  O115  1  0.71849200  0.66903700  0.89907900  1
  O  O116  1  0.43567100  0.23569600  0.82352200  1
  O  O117  1  0.41778500  0.05118300  0.93210700  1
  O  O118  1  0.13320900  0.62824300  0.57599200  1
  O  O119  1  0.20653500  0.39141400  0.89135400  1
  O  O120  1  0.48297700  0.68292900  0.67809700  1
  O  O121  1  0.84850300  0.35481300  0.25613500  1
  O  O122  1  0.79575900  0.55030300  0.80531400  1
  O  O123  1  0.70424100  0.55030300  0.30531400  1
  O  O124  1  0.65149700  0.35481300  0.75613500  1
  O  O125  1  0.73421200  0.23379600  0.53836600  1
  O  O126  1  0.79909200  0.12417100  0.93404800  1
  O  O127  1  0.49462100  0.26093700  0.46495200  1
  O  O128  1  0.93567100  0.76430400  0.67647800  1
  O  O129  1  0.13571400  0.86866800  0.74024900  1
  O  O130  1  0.21849200  0.33096300  0.60092100  1
  O  O131  1  0.99462100  0.73906300  0.03504800  1
