data_global
_chemical_name_mineral 'Gatehouseite'
loop_
_publ_author_name
'Ruszala F A'
'Anderson J B'
'Kostiner E'
_journal_name_full 'Inorganic Chemistry'
_journal_volume 16 
_journal_year 1977
_journal_page_first 2417
_journal_page_last 2422
_publ_section_title
;
 Crystal structures of two isomorphs of arsenoclasite:
 Co5(PO4)2(OH)4 and Mn5(PO4)2(OH)4
;
_database_code_amcsd 0012684
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'Mn5 P2 O12 H4'
_cell_length_a 9.110
_cell_length_b 18.032
_cell_length_c 5.6923
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 935.083
_exptl_crystal_density_diffrn      3.784
_symmetry_space_group_name_H-M 'P 21 21 21'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,1/2+y,1/2-z'
  '1/2+x,1/2-y,-z'
  '1/2-x,-y,1/2+z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Mn1   0.37734   0.12443   0.44640
Mn2   0.39044   0.02892   0.94930
Mn3   0.35093   0.22503   0.93500
Mn4   0.74725   0.93286   0.76530
Mn5   0.50318   0.81984   0.08600
P1   0.67870   0.12243   0.80520
P2   0.42970   0.87349   0.61970
O1   0.74400   0.85660   0.07420
O2   0.50930   0.12710   0.77600
O3   0.72600   0.17130   0.01100
O4   0.71770   0.04240   0.88030
O5   0.26030   0.87550   0.61950
O6   0.49590   0.92970   0.79440
O7   0.48330   0.89080   0.37150
O8   0.48200   0.79760   0.71130
O-H9   0.46750   0.21750   0.25380
O-H10   0.26480   0.79500   0.11900
O-H11   0.25450   0.04340   0.64270
O-H12   0.51810   0.04810   0.27040
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Mn1 0.01254 0.01356 0.01165 0.00051 -0.00013 -0.00025
Mn2 0.01393 0.01229 0.01254 -0.00114 0.00038 0.00000
Mn3 0.01431 0.01394 0.01203 -0.00114 0.00127 -0.00050
Mn4 0.01292 0.01305 0.01267 0.00012 -0.00051 0.00000
Mn5 0.01406 0.01558 0.01191 0.00102 -0.00025 -0.00063
P1 0.00912 0.01254 0.00887 0.00063 0.00025 -0.00076
P2 0.01051 0.01153 0.00963 0.00063 -0.00013 0.00025
O1 0.01216 0.01483 0.01279 -0.00152 0.00013 0.00025
O2 0.01152 0.01761 0.01431 -0.00241 -0.00190 0.00114
O3 0.01152 0.01456 0.01418 0.00165 -0.00215 -0.00139
O4 0.01723 0.01089 0.01305 0.00089 -0.00101 -0.00165
O5 0.01115 0.01634 0.01279 -0.00126 0.00063 -0.00139
O6 0.01279 0.01748 0.01634 0.00102 -0.00101 -0.00367
O7 0.01292 0.01520 0.01102 -0.00025 0.00025 0.00139
O8 0.01482 0.01202 0.01292 0.00051 0.00076 0.00000
O-H9 0.01330 0.01418 0.01115 -0.00202 0.00025 0.00000
O-H10 0.01495 0.01405 0.01355 -0.00051 -0.00063 -0.00190
O-H11 0.01583 0.01431 0.01267 0.00025 0.00063 -0.00025
O-H12 0.01330 0.01254 0.01431 0.00279 -0.00152 -0.00050