# generated using pymatgen
data_Li3Mn2(CO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.63019000
_cell_length_b   11.70386800
_cell_length_c   5.79366100
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn2(CO5)2
_chemical_formula_sum   'Li12 Mn8 C8 O40'
_cell_volume   653.00626925
_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  0.99683200  0.00187700  0.75000000  1
  Li  Li1  1  0.00134800  0.49555500  0.99774500  1
  Li  Li2  1  0.00134800  0.49555500  0.50225500  1
  Li  Li3  1  0.00167100  0.27938000  0.25000000  1
  Li  Li4  1  0.49832900  0.77938000  0.25000000  1
  Li  Li5  1  0.50316800  0.50187700  0.75000000  1
  Li  Li6  1  0.49865200  0.99555600  0.99774500  1
  Li  Li7  1  0.49865200  0.99555600  0.50225500  1
  Li  Li8  1  0.50248600  0.21914200  0.25000000  1
  Li  Li9  1  0.50567900  0.21884500  0.75000000  1
  Li  Li10  1  0.99751400  0.71914200  0.25000000  1
  Li  Li11  1  0.99432100  0.71884500  0.75000000  1
  Mn  Mn12  1  0.24464100  0.11178800  0.99912800  1
  Mn  Mn13  1  0.24464100  0.11178800  0.50087200  1
  Mn  Mn14  1  0.25535900  0.61178800  0.99912800  1
  Mn  Mn15  1  0.25535900  0.61178800  0.50087200  1
  Mn  Mn16  1  0.74422800  0.38830600  0.00039800  1
  Mn  Mn17  1  0.74422800  0.38830600  0.49960200  1
  Mn  Mn18  1  0.75577200  0.88830600  0.00039800  1
  Mn  Mn19  1  0.75577200  0.88830600  0.49960200  1
  C  C20  1  0.23905600  0.86227200  0.49926700  1
  C  C21  1  0.23905600  0.86227200  0.00073300  1
  C  C22  1  0.26094400  0.36227200  0.00073300  1
  C  C23  1  0.26094400  0.36227200  0.49926700  1
  C  C24  1  0.74203800  0.63890400  0.00001000  1
  C  C25  1  0.74203800  0.63890400  0.49999000  1
  C  C26  1  0.75796200  0.13890400  0.00001000  1
  C  C27  1  0.75796200  0.13890400  0.49999000  1
  O  O28  1  0.12812800  0.14878200  0.25000000  1
  O  O29  1  0.12498300  0.14344400  0.75000000  1
  O  O30  1  0.13023500  0.57691100  0.25000000  1
  O  O31  1  0.12976200  0.57768300  0.75000000  1
  O  O32  1  0.13071100  0.36188500  0.01054000  1
  O  O33  1  0.13071100  0.36188500  0.48946000  1
  O  O34  1  0.16328400  0.95521100  0.99189800  1
  O  O35  1  0.16328400  0.95521100  0.50810200  1
  O  O36  1  0.16482500  0.76692600  0.99900600  1
  O  O37  1  0.16482500  0.76692600  0.50099400  1
  O  O38  1  0.33517500  0.26692600  0.99900600  1
  O  O39  1  0.33517500  0.26692600  0.50099400  1
  O  O40  1  0.33671600  0.45521100  0.99189800  1
  O  O41  1  0.33671600  0.45521100  0.50810200  1
  O  O42  1  0.36928900  0.86188500  0.01054000  1
  O  O43  1  0.36928900  0.86188500  0.48946000  1
  O  O44  1  0.36976500  0.07691100  0.25000000  1
  O  O45  1  0.37023800  0.07768300  0.75000000  1
  O  O46  1  0.37187200  0.64878200  0.25000000  1
  O  O47  1  0.37501700  0.64344400  0.75000000  1
  O  O48  1  0.62780700  0.35163000  0.25000000  1
  O  O49  1  0.62140200  0.35591000  0.75000000  1
  O  O50  1  0.62959500  0.92274000  0.25000000  1
  O  O51  1  0.63537900  0.92609900  0.75000000  1
  O  O52  1  0.62567700  0.13767500  0.99995700  1
  O  O53  1  0.62567700  0.13767500  0.50004300  1
  O  O54  1  0.66635900  0.54625400  0.99546100  1
  O  O55  1  0.66635900  0.54625400  0.50453900  1
  O  O56  1  0.67020500  0.73339300  0.00461600  1
  O  O57  1  0.67020500  0.73339300  0.49538400  1
  O  O58  1  0.82979500  0.23339300  0.00461600  1
  O  O59  1  0.82979500  0.23339300  0.49538400  1
  O  O60  1  0.83364100  0.04625400  0.99546100  1
  O  O61  1  0.83364100  0.04625400  0.50453900  1
  O  O62  1  0.87432300  0.63767500  0.99995700  1
  O  O63  1  0.87432300  0.63767500  0.50004300  1
  O  O64  1  0.87040500  0.42274000  0.25000000  1
  O  O65  1  0.86462100  0.42609900  0.75000000  1
  O  O66  1  0.87219300  0.85163000  0.25000000  1
  O  O67  1  0.87859800  0.85591000  0.75000000  1
