# generated using pymatgen
data_Cr7Ni20Mo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.20316969
_cell_length_b   6.20333427
_cell_length_c   18.95314590
_cell_angle_alpha   90.11906711
_cell_angle_beta   96.30080498
_cell_angle_gamma   108.52057002
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr7Ni20Mo3
_chemical_formula_sum   'Cr14 Ni40 Mo6'
_cell_volume   686.84598493
_cell_formula_units_Z   2
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
  Cr  Cr0  1  0.79978000  0.60023700  0.79989200  1
  Cr  Cr1  1  0.30010300  0.09979000  0.79997600  1
  Cr  Cr2  1  0.54917300  0.84921500  0.79994700  1
  Cr  Cr3  1  0.05085600  0.35064300  0.79989700  1
  Cr  Cr4  1  0.59650500  0.20437000  0.60034500  1
  Cr  Cr5  1  0.35001100  0.44955500  0.60038900  1
  Cr  Cr6  1  0.10329000  0.69614400  0.60044500  1
  Cr  Cr7  1  0.89999300  0.30046300  0.40066200  1
  Cr  Cr8  1  0.65436900  0.54459600  0.40063800  1
  Cr  Cr9  1  0.14669000  0.05494200  0.40063300  1
  Cr  Cr10  1  0.44987400  0.15017700  0.19997600  1
  Cr  Cr11  1  0.49552600  0.50329500  0.99905500  1
  Cr  Cr12  1  0.00402900  0.99632500  0.99911500  1
  Cr  Cr13  1  0.24965300  0.75055700  0.99905100  1
  Ni  Ni14  1  0.40034200  0.46625900  0.73322400  1
  Ni  Ni15  1  0.90055800  0.96676700  0.73476600  1
  Ni  Ni16  1  0.14930100  0.71739300  0.73329000  1
  Ni  Ni17  1  0.65028800  0.21602700  0.73296900  1
  Ni  Ni18  1  0.20405700  0.06768100  0.53270500  1
  Ni  Ni19  1  0.44633800  0.81471500  0.53434700  1
  Ni  Ni20  1  0.95170000  0.32035100  0.53261600  1
  Ni  Ni21  1  0.69714200  0.56356000  0.53272000  1
  Ni  Ni22  1  0.50197800  0.17038500  0.33314300  1
  Ni  Ni23  1  0.24773600  0.41332400  0.33478400  1
  Ni  Ni24  1  0.75512400  0.91820200  0.33444500  1
  Ni  Ni25  1  0.99635700  0.66481700  0.33489500  1
  Ni  Ni26  1  0.54838800  0.51219300  0.13087900  1
  Ni  Ni27  1  0.05211400  0.01785600  0.13090400  1
  Ni  Ni28  1  0.29997500  0.76988600  0.13064100  1
  Ni  Ni29  1  0.79585200  0.26558100  0.13250500  1
  Ni  Ni30  1  0.34575800  0.11456800  0.93243600  1
  Ni  Ni31  1  0.10338900  0.36834800  0.93219300  1
  Ni  Ni32  1  0.59792100  0.86240400  0.93215300  1
  Ni  Ni33  1  0.85160700  0.62028700  0.93210700  1
  Ni  Ni34  1  0.74824000  0.57982100  0.66748900  1
  Ni  Ni35  1  0.25416400  0.08536400  0.66751000  1
  Ni  Ni36  1  0.49652300  0.83163500  0.66773500  1
  Ni  Ni37  1  0.00209900  0.33737000  0.66740700  1
  Ni  Ni38  1  0.55282100  0.18688000  0.46730000  1
  Ni  Ni39  1  0.80411800  0.93536200  0.46617100  1
  Ni  Ni40  1  0.29825400  0.42960500  0.46768500  1
  Ni  Ni41  1  0.04593200  0.68214800  0.46770000  1
  Ni  Ni42  1  0.84756800  0.28267500  0.26946800  1
  Ni  Ni43  1  0.59939100  0.53074300  0.26908200  1
  Ni  Ni44  1  0.10508900  0.03418500  0.26911800  1
  Ni  Ni45  1  0.35137500  0.78716900  0.26745700  1
  Ni  Ni46  1  0.90144700  0.63703700  0.06522400  1
  Ni  Ni47  1  0.39646100  0.13155500  0.06695000  1
  Ni  Ni48  1  0.64829600  0.87853000  0.06535100  1
  Ni  Ni49  1  0.15292700  0.38582400  0.06534700  1
  Ni  Ni50  1  0.69921600  0.23326200  0.86506200  1
  Ni  Ni51  1  0.45072900  0.48261600  0.86660500  1
  Ni  Ni52  1  0.94956100  0.98396500  0.86695100  1
  Ni  Ni53  1  0.19970400  0.73376800  0.86664500  1
  Mo  Mo54  1  0.85097500  0.95002200  0.60042300  1
  Mo  Mo55  1  0.39988300  0.80034700  0.40081300  1
  Mo  Mo56  1  0.94970300  0.65022400  0.19993900  1
  Mo  Mo57  1  0.69450600  0.90536400  0.19992600  1
  Mo  Mo58  1  0.20613300  0.39395200  0.19998400  1
  Mo  Mo59  1  0.74911500  0.24966800  0.99891400  1
