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#$Date: 2016-12-12 16:02:45 +0200 (Mon, 12 Dec 2016) $
#$Revision: 189075 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/00/23/4002352.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4002352
loop_
_publ_author_name
'Zhang, H.-Y.'
'Zhao, D.-Y.'
'Shi, Z.'
'Chen, M.-Q.'
'Zhou, Y.-M.'
'Xu, X.'
'Bu Xianhui'
_publ_section_title
;
 Hydrothermal synthesis of new pure beryllophosphate molecular sieve
 phases from concentrated amines
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              2042
_journal_page_last               2048
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'Be H4 N O4 P'
_chemical_name_systematic        '(N H4) Be (P O4)'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P 2c -2n'
_symmetry_space_group_name_H-M   'P n a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.7173
_cell_length_b                   8.5889
_cell_length_c                   4.9673
_cell_volume                     371.912
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Zhang_CMATEX_2001_943.cif
_cod_data_source_block           H4Be1N1O4P1
_cod_original_cell_volume        371.9118
_cod_original_formula_sum        'H4 Be1 N1 O4 P1'
_cod_database_code               4002352
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x+1/2,y+1/2,z+1/2
x+1/2,-y+1/2,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
_atom_site_attached_hydrogens
O2 O-2 0.7324 -0.0425 0.6805 1 0.0 0
O3 O-2 0.7614 0.2372 0.8032 1 0.0 0
O1 O-2 0.7355 0.0359 0.1641 1 0.0 0
Be1 Be+2 0.3258 0.0924 0.8799 1 0.0 0
P1 P+5 0.6834 0.0854 0.8799 1 0.0 0
O4 O-2 0.5109 0.1083 0.8739 1 0.0 0
N1 N-3 0.9953 0.1916 0.3746 1 0.0 4
