# CIF file 
data_findsym-output
_audit_creation_method FINDSYM

_chemical_name_mineral ''
_chemical_formula_sum 'Ni3 P'

loop_
_publ_author_name
 'S. Rundqvist'
 'E. Hassler'
 'L. Lundvik'
_journal_name_full_name
;
 Acta Chemica Scandinavica
;
_journal_volume 16
_journal_year 1962
_journal_page_first 242
_journal_page_last 243
_publ_Section_title
;
 Refinement of the Ni$_{3}$P Structure
;

_aflow_title 'Ni$_{3}$P ($D0_{e}$) Structure'
_aflow_proto 'A3B_tI32_82_3g_g'
_aflow_params 'a,c/a,x_{1},y_{1},z_{1},x_{2},y_{2},z_{2},x_{3},y_{3},z_{3},x_{4},y_{4},z_{4}'
_aflow_params_values '8.954,0.495711413893,0.0775,0.1117,0.2391,0.3649,0.0321,0.9765,0.1689,0.22,0.7524,0.2862,0.0487,0.4807'
_aflow_Strukturbericht '$D0_{e}$'
_aflow_Pearson 'tI32'

_symmetry_space_group_name_H-M "I-4"
_symmetry_Int_Tables_number 82
 
_cell_length_a    8.95400
_cell_length_b    8.95400
_cell_length_c    4.43860
_cell_angle_alpha 90.00000
_cell_angle_beta  90.00000
_cell_angle_gamma 90.00000
 
loop_
_space_group_symop_id
_space_group_symop_operation_xyz
1 x,y,z
2 -x,-y,z
3 y,-x,-z
4 -y,x,-z
5 x+1/2,y+1/2,z+1/2
6 -x+1/2,-y+1/2,z+1/2
7 y+1/2,-x+1/2,-z+1/2
8 -y+1/2,x+1/2,-z+1/2
 
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
Ni1 Ni   8 g  0.07750 0.11170 0.23910 1.00000
Ni2 Ni   8 g  0.36490 0.03210 0.97650 1.00000
Ni3 Ni   8 g  0.16890 0.22000 0.75240 1.00000
P1  P    8 g  0.28620 0.04870 0.48070 1.00000
