# CIF file 
data_findsym-output
_audit_creation_method FINDSYM

_chemical_name_mineral ''
_chemical_formula_sum 'Cu3 P'

loop_
_publ_author_name
 'O. Olofsson'
_journal_name_full_name
;
 Acta Chemica Scandinavica
;
_journal_volume 26
_journal_year 1972
_journal_page_first 2777
_journal_page_last 2787
_publ_Section_title
;
 The Crystal Structure of Cu$_{3}$P
;

_aflow_title 'Cu$_{3}$P Structure'
_aflow_proto 'A3B_hP24_185_ab2c_c'
_aflow_params 'a,c/a,z_{1},z_{2},x_{3},z_{3},x_{4},z_{4},x_{5},z_{5}'
_aflow_params_values '6.9593,1.02639633296,0.3213,0.1998,0.2806,0.0765,0.3761,0.4246,0.3322,0.75'
_aflow_Strukturbericht 'None'
_aflow_Pearson 'hP24'

_symmetry_space_group_name_H-M "P 63 c m"
_symmetry_Int_Tables_number 185
 
_cell_length_a    6.95930
_cell_length_b    6.95930
_cell_length_c    7.14300
_cell_angle_alpha 90.00000
_cell_angle_beta  90.00000
_cell_angle_gamma 120.00000
 
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 x-y,x,z+1/2
3 -y,x-y,z
4 -x,-y,z+1/2
5 -x+y,-x,z
6 y,-x+y,z+1/2
7 -x+y,y,z+1/2
8 -x,-x+y,z
9 -y,-x,z+1/2
10 x-y,-y,z
11 x,x-y,z+1/2
12 y,x,z
 
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Cu1 Cu   2 a 0.00000 0.00000 0.32130 1.00000
Cu2 Cu   4 b 0.33333 0.66667 0.19980 1.00000
Cu3 Cu   6 c 0.28060 0.00000 0.07650 1.00000
Cu4 Cu   6 c 0.37610 0.00000 0.42460 1.00000
P1  P    6 c 0.33220 0.00000 0.75000 1.00000
