#------------------------------------------------------------------------------
#$Date: 2024-05-29 17:00:33 +0300 (Wed, 29 May 2024) $
#$Revision: 292100 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/60/9016040.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9016040
loop_
_publ_author_name
'Cousson, A.'
'Gasperin, M.'
_publ_section_title
;
 Nouvelle description du tetrafluorure de neptunium hydrate, Np3F12H2O
 _cod_database_code 1001332
;
_journal_name_full               'Acta Crystallographica, Section C'
_journal_page_first              804
_journal_page_last               805
_journal_paper_doi               10.1107/S0108270185005571
_journal_volume                  41
_journal_year                    1985
_chemical_formula_sum            'F12 Np3 O'
_space_group_IT_number           8
_symmetry_space_group_name_Hall  'C -2y'
_symmetry_space_group_name_H-M   'C 1 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 128.77
_cell_angle_gamma                90
_cell_length_a                   12.023
_cell_length_b                   11.723
_cell_length_c                   8.435
_cell_formula_units_Z            4
_cell_volume                     926.926
_database_code_amcsd             0010008
_exptl_crystal_density_diffrn    6.843
_cod_duplicate_entry             1001332
_cod_original_formula_sum        'Np3 F12 O'
_cod_database_code               9016040
_amcsd_formula_title             Np3F12H2O
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,z
1/2+x,1/2-y,z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Np1 0.18580 0.00000 0.33700
Np2 0.81410 0.00000 0.66280
Np3 0.05340 0.32770 0.78450
Np4 -0.08010 0.68810 0.17710
F1 0.25990 0.67480 0.11180
F2 0.23900 0.61060 0.79670
F3 0.53690 0.64740 0.26150
F4 0.48850 0.80750 0.99250
F5 0.48770 0.76410 0.48680
F6 0.21010 0.82250 0.86850
F7 0.25990 0.88550 0.21480
F8 0.94290 0.84720 0.71910
F9 0.14080 0.61700 0.41130
F10 0.32560 0.87070 0.58940
F11 0.00480 0.00000 0.99880
F12 0.57400 0.00000 0.92290
F13 0.40190 0.00000 0.11130
F14 0.47030 0.00000 0.55820
O1 0.84340 0.00000 0.40400
O2 0.13070 0.00000 0.57840
loop_
_cod_related_entry_id
_cod_related_entry_database
_cod_related_entry_code
1 AMCSD 0010008
