data_1532142
_publ_section_title
;
 Topochemical formation of van der Waals type niobium carbosulfide 1T-(Nb2
 S2 C)
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              283
_journal_page_last               292
_journal_volume                  339
_journal_year                    2002
_chemical_formula_sum            'C Nb2 S2'
_chemical_name_systematic        'Nb2 S2 C'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            1
_cell_length_a                   3.269
_cell_length_b                   3.269
_cell_length_c                   8.547
_cell_volume                     79.100
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Sakamaki_JALCEU_2002_497.cif
_cod_data_source_block           C1Nb2S2
_cod_original_cell_volume        79.09958
_cod_chemical_formula_sum_orig   'C1 Nb2 S2'
_cod_database_code               1532142
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Nb1 Nb 0.3333 0.6667 0.141 1 0.0
S1 S 0.3333 0.6667 0.667 1 0.0
C1 C 0 0 0 1 0.0
