# Supplementary Information (SI) for Journal of Materials Chemistry C.
# This journal is © The Royal Society of Chemistry 2025

####################################################################### 
# 
# This file contains crystal structure data downloaded from the 
# Cambridge Structural Database (CSD) hosted by the Cambridge 
# Crystallographic Data Centre (CCDC).
# 
# Full information about CCDC data access policies and citation 
# guidelines are available at http://www.ccdc.cam.ac.uk/access/V1 
# 
# Audit and citation data items may have been added by the CCDC. 
# Please retain this information to preserve the provenance of 
# this file and to allow appropriate attribution of the data. 
# 
#######################################################################

data_VESTA_phase_1
_audit_block_doi                 10.25505/fiz.icsd.cc2lp3s6
_database_code_depnum_ccdc_archive 'CCDC 2403578'
loop_
_audit_author_name
_audit_author_address
'Qiang Gao'
;Shenyang University of Technology
China
;

_audit_update_record             
;
2024-11-18 deposited with the CCDC.	2025-01-28 downloaded from the CCDC.
;
_publcif_datablock.id            {1e46f6d9-0f7c-4475-a7fe-57cf56d70cba}

_chemical_name_common            'mosin                                 '
_cell_length_a                   3.507544
_cell_length_b                   3.507544
_cell_length_c                   25.000000
_cell_angle_alpha                90.000000
_cell_angle_beta                 90.000000
_cell_angle_gamma                120.000000
_cell_volume                     266.364809
_space_group_name_H-M_alt        'P 1'
_space_group_IT_number           1

loop_
_space_group_symop_operation_xyz
'x, y, z'

loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_adp_type
_atom_site_U_iso_or_equiv
_atom_site_type_symbol
V1 1.0 0.333333 0.666667 0.446346 Uiso ? V
Y1 1.0 0.666667 0.333333 0.547179 Uiso ? Y
N1 1.0 0.000000 0.000000 0.500000 Uiso ? N
F1 1.0 0.333333 0.666667 0.598181 Uiso ? F
F2 1.0 0.666667 0.333333 0.409221 Uiso ? F

loop_
_publcif_info_exptl_table_extra_item
?

loop_
_publcif_info_exptl_table_header_item
?



_publcif_funding_html            
;
;
