data_[Mg1Mn2P2H2O10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Mn  1.5500  1.4000  0.6483
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [5.2076]
_cell_length_b [5.5588]
_cell_length_c [7.2986]
_cell_angle_alpha [109.7084]
_cell_angle_beta [105.0541]
_cell_angle_gamma [100.6924]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [MgMn2P2(HO5)2]
_chemical_formula_sum '[Mg1 Mn2 P2 H2 O10]'
_cell_volume [183.2028]
_cell_formula_units_Z [1]
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
[
  Mg  Mg0  1  0.9191  0.5591  0.1591  1.0
  Mn  Mn1  1  0.5062  0.5020  0.5030  1.0
  Mn  Mn2  1  0.9866  0.9992  0.9863  1.0
  P  P3  1  0.4177  0.1310  0.7597  1.0
  P  P4  1  0.5662  0.8754  0.2390  1.0
  H  H5  1  0.0228  0.7038  0.6685  1.0
  H  H6  1  0.9950  0.2672  0.3457  1.0
  O  O7  1  0.1192  0.3252  0.2728  1.0
  O  O8  1  0.2474  0.7937  0.1461  1.0
  O  O9  1  0.2704  0.1809  0.9240  1.0
  O  O10  1  0.3201  0.8326  0.6117  1.0
  O  O11  1  0.3489  0.3108  0.6434  1.0
  O  O12  1  0.6601  0.6788  0.3392  1.0
  O  O13  1  0.6906  0.1727  0.3815  1.0
  O  O14  1  0.7054  0.8084  0.0669  1.0
  O  O15  1  0.7330  0.2300  0.8927  1.0
  O  O16  1  0.8705  0.6832  0.7270  1.0
]