# generated using pymatgen
data_Mn3Zn8N9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.64176923
_cell_length_b   10.63370064
_cell_length_c   16.60139159
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.90750065
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3Zn8N9
_chemical_formula_sum   'Mn12 Zn32 N36'
_cell_volume   995.84045142
_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
  Mn  Mn0  1  0.52180500  0.14717200  0.25711000  1
  Mn  Mn1  1  0.47819500  0.64717200  0.24289000  1
  Mn  Mn2  1  0.47819500  0.85282800  0.74289000  1
  Mn  Mn3  1  0.52180500  0.35282800  0.75711000  1
  Mn  Mn4  1  0.88692100  0.83632400  0.44780700  1
  Mn  Mn5  1  0.11307900  0.33632400  0.05219300  1
  Mn  Mn6  1  0.11307900  0.16367600  0.55219300  1
  Mn  Mn7  1  0.88692100  0.66367600  0.94780700  1
  Mn  Mn8  1  0.81522100  0.32080700  0.45391100  1
  Mn  Mn9  1  0.18477900  0.82080700  0.04608900  1
  Mn  Mn10  1  0.18477900  0.67919300  0.54608900  1
  Mn  Mn11  1  0.81522100  0.17919300  0.95391100  1
  Zn  Zn12  1  0.56108200  0.84376900  0.91304000  1
  Zn  Zn13  1  0.43891800  0.34376900  0.58696000  1
  Zn  Zn14  1  0.43891800  0.15623100  0.08696000  1
  Zn  Zn15  1  0.56108200  0.65623100  0.41304000  1
  Zn  Zn16  1  0.54008500  0.11554800  0.44106600  1
  Zn  Zn17  1  0.45991500  0.61554800  0.05893400  1
  Zn  Zn18  1  0.45991500  0.88445200  0.55893400  1
  Zn  Zn19  1  0.54008500  0.38445200  0.94106600  1
  Zn  Zn20  1  0.84118400  0.89955600  0.25175800  1
  Zn  Zn21  1  0.15881600  0.39955600  0.24824200  1
  Zn  Zn22  1  0.15881600  0.10044400  0.74824200  1
  Zn  Zn23  1  0.84118400  0.60044400  0.75175800  1
  Zn  Zn24  1  0.65982700  0.42470600  0.31967300  1
  Zn  Zn25  1  0.34017300  0.92470600  0.18032700  1
  Zn  Zn26  1  0.34017300  0.57529400  0.68032700  1
  Zn  Zn27  1  0.65982700  0.07529400  0.81967300  1
  Zn  Zn28  1  0.64532600  0.39494100  0.14523700  1
  Zn  Zn29  1  0.35467400  0.89494100  0.35476300  1
  Zn  Zn30  1  0.35467400  0.60505900  0.85476300  1
  Zn  Zn31  1  0.64532600  0.10505900  0.64523700  1
  Zn  Zn32  1  0.96442000  0.14878800  0.15132200  1
  Zn  Zn33  1  0.03558000  0.64878800  0.34867800  1
  Zn  Zn34  1  0.03558000  0.85121200  0.84867800  1
  Zn  Zn35  1  0.96442000  0.35121200  0.65132200  1
  Zn  Zn36  1  0.03146800  0.16063800  0.34509800  1
  Zn  Zn37  1  0.96853200  0.66063800  0.15490200  1
  Zn  Zn38  1  0.96853200  0.83936200  0.65490200  1
  Zn  Zn39  1  0.03146800  0.33936200  0.84509800  1
  Zn  Zn40  1  0.24858600  0.42175600  0.43909800  1
  Zn  Zn41  1  0.75141400  0.92175600  0.06090200  1
  Zn  Zn42  1  0.75141400  0.57824400  0.56090200  1
  Zn  Zn43  1  0.24858600  0.07824400  0.93909800  1
  N  N44  1  0.52759100  0.31974400  0.41854300  1
  N  N45  1  0.47240900  0.81974500  0.08145700  1
  N  N46  1  0.47240900  0.68025600  0.58145700  1
  N  N47  1  0.52759100  0.18025600  0.91854300  1
  N  N48  1  0.48172200  0.30961800  0.23911200  1
  N  N49  1  0.51827800  0.80961800  0.26088800  1
  N  N50  1  0.51827800  0.69038200  0.76088800  1
  N  N51  1  0.48172200  0.19038200  0.73911200  1
  N  N52  1  0.77097000  0.10450400  0.05245600  1
  N  N53  1  0.22903000  0.60450400  0.44754400  1
  N  N54  1  0.22903000  0.89549600  0.94754400  1
  N  N55  1  0.77097000  0.39549600  0.55245600  1
  N  N56  1  0.59359600  0.88431000  0.44825900  1
  N  N57  1  0.40640400  0.38431000  0.05174100  1
  N  N58  1  0.40640400  0.11569000  0.55174100  1
  N  N59  1  0.59359600  0.61569000  0.94825900  1
  N  N60  1  0.82004000  0.09270500  0.25500800  1
  N  N61  1  0.17996000  0.59270500  0.24499200  1
  N  N62  1  0.17996000  0.90729500  0.74499200  1
  N  N63  1  0.82004000  0.40729500  0.75500800  1
  N  N64  1  0.99262200  0.36235800  0.36009200  1
  N  N65  1  0.00737800  0.86235800  0.13990800  1
  N  N66  1  0.00737800  0.63764200  0.63990800  1
  N  N67  1  0.99262200  0.13764200  0.86009200  1
  N  N68  1  0.98585100  0.34060500  0.14751400  1
  N  N69  1  0.01414900  0.84060500  0.35248600  1
  N  N70  1  0.01414900  0.65939500  0.85248600  1
  N  N71  1  0.98585100  0.15939500  0.64751400  1
  N  N72  1  0.91194400  0.15512700  0.46538800  1
  N  N73  1  0.08805600  0.65512700  0.03461200  1
  N  N74  1  0.08805600  0.84487300  0.53461200  1
  N  N75  1  0.91194400  0.34487300  0.96538800  1
  N  N76  1  0.35564800  0.08446900  0.33660400  1
  N  N77  1  0.64435200  0.58446900  0.16339600  1
  N  N78  1  0.64435200  0.91553100  0.66339600  1
  N  N79  1  0.35564800  0.41553100  0.83660400  1
