# generated using pymatgen
data_LiVCr(P2O7)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.15547900
_cell_length_b   9.67699245
_cell_length_c   16.83835270
_cell_angle_alpha   102.12327961
_cell_angle_beta   96.10596843
_cell_angle_gamma   111.34158987
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiVCr(P2O7)2
_chemical_formula_sum   'Li4 V4 Cr4 P16 O56'
_cell_volume   1040.16345786
_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  0.29035200  0.96525000  0.43230600  1
  Li  Li1  1  0.26508000  0.59081900  0.68040500  1
  Li  Li2  1  0.01328200  0.34092500  0.18093400  1
  Li  Li3  1  0.03990700  0.71474100  0.93240200  1
  V  V4  1  0.15777000  0.88027800  0.24786300  1
  V  V5  1  0.90163700  0.63000900  0.74804900  1
  V  V6  1  0.65489800  0.38291800  0.25331900  1
  V  V7  1  0.41146600  0.13362300  0.75309500  1
  Cr  Cr8  1  0.72273900  0.99435500  0.50283800  1
  Cr  Cr9  1  0.47373300  0.74468400  0.00298800  1
  Cr  Cr10  1  0.21744800  0.49379200  0.49879900  1
  Cr  Cr11  1  0.96692600  0.24389300  0.99847000  1
  P  P12  1  0.33411800  0.85689800  0.59146300  1
  P  P13  1  0.08193600  0.60522900  0.09037900  1
  P  P14  1  0.79476400  0.88179400  0.89150300  1
  P  P15  1  0.54655700  0.63141900  0.39170700  1
  P  P16  1  0.97359900  0.89016900  0.64174200  1
  P  P17  1  0.72087900  0.63623100  0.14169400  1
  P  P18  1  0.38019200  0.85784600  0.83980800  1
  P  P19  1  0.13346900  0.60890700  0.34096900  1
  P  P20  1  0.83304600  0.35252900  0.58755700  1
  P  P21  1  0.58565500  0.10433300  0.08839300  1
  P  P22  1  0.29492800  0.38071900  0.89107200  1
  P  P23  1  0.04281400  0.13101700  0.39112000  1
  P  P24  1  0.47292700  0.38361100  0.64090400  1
  P  P25  1  0.22576400  0.13727800  0.14099500  1
  P  P26  1  0.88150800  0.35798500  0.83987500  1
  P  P27  1  0.62793700  0.10631200  0.33884500  1
  O  O28  1  0.54816900  0.94118000  0.08999100  1
  O  O29  1  0.45545500  0.98614200  0.26917300  1
  O  O30  1  0.13389500  0.98526600  0.16546900  1
  O  O31  1  0.80192700  0.91327800  0.59503600  1
  O  O32  1  0.55277900  0.66425400  0.09560200  1
  O  O33  1  0.66177700  0.80430300  0.41178700  1
  O  O34  1  0.42699800  0.91032000  0.52020900  1
  O  O35  1  0.17721500  0.66063600  0.02019700  1
  O  O36  1  0.44794700  0.96728400  0.67655200  1
  O  O37  1  0.19697500  0.71536400  0.17608400  1
  O  O38  1  0.16619300  0.77443700  0.33731100  1
  O  O39  1  0.86265400  0.76720700  0.21771500  1
  O  O40  1  0.10986000  0.86258100  0.57438900  1
  O  O41  1  0.85967800  0.61263200  0.07411400  1
  O  O42  1  0.58371400  0.83116600  0.82440500  1
  O  O43  1  0.33527100  0.58289200  0.32313500  1
  O  O44  1  0.74468100  0.82400900  0.96749400  1
  O  O45  1  0.48831600  0.57420000  0.46673500  1
  O  O46  1  0.30181900  0.69215200  0.59163200  1
  O  O47  1  0.05158300  0.44155100  0.09148000  1
  O  O48  1  0.34020700  0.83248100  0.92397700  1
  O  O49  1  0.10124000  0.59051700  0.42604200  1
  O  O50  1  0.21294000  0.73204900  0.76867700  1
  O  O51  1  0.96442300  0.48531300  0.26965200  1
  O  O52  1  0.88708700  0.73867200  0.66930500  1
  O  O53  1  0.63658200  0.48627300  0.16890900  1
  O  O54  1  0.91092400  0.79541400  0.84441200  1
  O  O55  1  0.66008100  0.54877300  0.34126200  1
  O  O56  1  0.30704700  0.42276200  0.59897400  1
  O  O57  1  0.05703000  0.17302400  0.09863800  1
  O  O58  1  0.41175500  0.55387100  0.91141300  1
  O  O59  1  0.16066000  0.30326000  0.40958900  1
  O  O60  1  0.93346800  0.41008100  0.51982900  1
  O  O61  1  0.68347900  0.15940600  0.01943300  1
  O  O62  1  0.95160600  0.46921600  0.67378900  1
  O  O63  1  0.70338000  0.22059900  0.17405200  1
  O  O64  1  0.91718000  0.52537400  0.83589100  1
  O  O65  1  0.66312300  0.27078600  0.33360200  1
  O  O66  1  0.60627800  0.51739100  0.71806100  1
  O  O67  1  0.35608400  0.26943600  0.21848200  1
  O  O68  1  0.61114600  0.36481200  0.57412800  1
  O  O69  1  0.36217000  0.11548600  0.07442800  1
  O  O70  1  0.08445200  0.33417700  0.82259300  1
  O  O71  1  0.83256400  0.08196700  0.32396000  1
  O  O72  1  0.23776400  0.32444600  0.96649000  1
  O  O73  1  0.99370900  0.07430800  0.46752800  1
  O  O74  1  0.79797100  0.19048600  0.59005600  1
  O  O75  1  0.85317700  0.34221700  0.92591200  1
  O  O76  1  0.59182000  0.08370600  0.42399600  1
  O  O77  1  0.70804300  0.23942300  0.76999200  1
  O  O78  1  0.38307300  0.23307600  0.66570300  1
  O  O79  1  0.40718500  0.29722800  0.84058200  1
  O  O80  1  0.15797000  0.04377300  0.34405700  1
  O  O81  1  0.91120300  0.05384700  0.90987400  1
  O  O82  1  0.41251100  0.02085000  0.83526700  1
  O  O83  1  0.11125400  0.01915900  0.71809700  1
