International Tables for Crystallography
Core dictionary (coreCIF) version 2.3.1 definitions
Definitions are arranged alphabetically by category and within category.
- Revision history
- _atom_site_[]
- _atom_site_adp_type
- _atom_site_aniso_B_11
- _atom_site_aniso_B_12
- _atom_site_aniso_B_13
- _atom_site_aniso_B_22
- _atom_site_aniso_B_23
- _atom_site_aniso_B_33
- _atom_site_aniso_label
- _atom_site_aniso_ratio
- _atom_site_aniso_type_symbol
- _atom_site_aniso_U_11
- _atom_site_aniso_U_12
- _atom_site_aniso_U_13
- _atom_site_aniso_U_22
- _atom_site_aniso_U_23
- _atom_site_aniso_U_33
- _atom_site_attached_hydrogens
- _atom_site_B_equiv_geom_mean
- _atom_site_B_iso_or_equiv
- _atom_site_calc_attached_atom
- _atom_site_calc_flag
- _atom_site_Cartn_x
- _atom_site_Cartn_y
- _atom_site_Cartn_z
- _atom_site_chemical_conn_number
- _atom_site_constraints
- _atom_site_description
- _atom_site_disorder_assembly
- _atom_site_disorder_group
- _atom_site_fract_x
- _atom_site_fract_y
- _atom_site_fract_z
- _atom_site_label
- _atom_site_label_component_0
- _atom_site_label_component_1
- _atom_site_label_component_2
- _atom_site_label_component_3
- _atom_site_label_component_4
- _atom_site_label_component_5
- _atom_site_label_component_6
- _atom_site_occupancy
- _atom_site_refinement_flags
- _atom_site_refinement_flags_adp
- _atom_site_refinement_flags_occupancy
- _atom_site_refinement_flags_posn
- _atom_site_restraints
- _atom_site_symmetry_multiplicity
- _atom_site_thermal_displace_type
- _atom_site_type_symbol
- _atom_site_U_equiv_geom_mean
- _atom_site_U_iso_or_equiv
- _atom_site_Wyckoff_symbol
- _atom_sites_[]
- _atom_sites_Cartn_tran_matrix_11
- _atom_sites_Cartn_tran_matrix_12
- _atom_sites_Cartn_tran_matrix_13
- _atom_sites_Cartn_tran_matrix_21
- _atom_sites_Cartn_tran_matrix_22
- _atom_sites_Cartn_tran_matrix_23
- _atom_sites_Cartn_tran_matrix_31
- _atom_sites_Cartn_tran_matrix_32
- _atom_sites_Cartn_tran_matrix_33
- _atom_sites_Cartn_transform_axes
- _atom_sites_Cartn_tran_vector_1
- _atom_sites_Cartn_tran_vector_2
- _atom_sites_Cartn_tran_vector_3
- _atom_sites_fract_tran_matrix_11
- _atom_sites_fract_tran_matrix_12
- _atom_sites_fract_tran_matrix_13
- _atom_sites_fract_tran_matrix_21
- _atom_sites_fract_tran_matrix_22
- _atom_sites_fract_tran_matrix_23
- _atom_sites_fract_tran_matrix_31
- _atom_sites_fract_tran_matrix_32
- _atom_sites_fract_tran_matrix_33
- _atom_sites_fract_tran_vector_1
- _atom_sites_fract_tran_vector_2
- _atom_sites_fract_tran_vector_3
- _atom_sites_solution_primary
- _atom_sites_solution_secondary
- _atom_sites_solution_hydrogens
- _atom_sites_special_details
- _atom_type_[]
- _atom_type_analytical_mass_%
- _atom_type_description
- _atom_type_number_in_cell
- _atom_type_oxidation_number
- _atom_type_radius_bond
- _atom_type_radius_contact
- _atom_type_scat_Cromer_Mann_a1
- _atom_type_scat_Cromer_Mann_a2
- _atom_type_scat_Cromer_Mann_a3
- _atom_type_scat_Cromer_Mann_a4
- _atom_type_scat_Cromer_Mann_b1
- _atom_type_scat_Cromer_Mann_b2
- _atom_type_scat_Cromer_Mann_b3
- _atom_type_scat_Cromer_Mann_b4
- _atom_type_scat_Cromer_Mann_c
- _atom_type_scat_dispersion_imag
- _atom_type_scat_dispersion_real
- _atom_type_scat_dispersion_source
- _atom_type_scat_length_neutron
- _atom_type_scat_source
- _atom_type_scat_versus_stol_list
- _atom_type_symbol
- _audit_[]
- _audit_author_[]
- _audit_conform_[]
- _audit_contact_author_[]
- _audit_contact_author_address
- _audit_contact_author_email
- _audit_contact_author_fax
- _audit_contact_author_name
- _audit_contact_author_phone
- _audit_link_[]
- _cell_[]
- _cell_angle_alpha
- _cell_angle_beta
- _cell_angle_gamma
- _cell_formula_units_Z
- _cell_length_a
- _cell_length_b
- _cell_length_c
- _cell_measurement_pressure
- _cell_measurement_radiation
- _cell_measurement_reflns_used
- _cell_measurement_temperature
- _cell_measurement_theta_max
- _cell_measurement_theta_min
- _cell_measurement_wavelength
- _cell_reciprocal_angle_alpha
- _cell_reciprocal_angle_beta
- _cell_reciprocal_angle_gamma
- _cell_reciprocal_length_a
- _cell_reciprocal_length_b
- _cell_reciprocal_length_c
- _cell_special_details
- _cell_volume
- _cell_measurement_refln_[]
- _cell_measurement_refln_index_h
- _cell_measurement_refln_index_k
- _cell_measurement_refln_index_l
- _cell_measurement_refln_theta
- _chemical_[]
- _chemical_absolute_configuration
- _chemical_compound_source
- _chemical_melting_point
- _chemical_melting_point_gt
- _chemical_melting_point_lt
- _chemical_name_common
- _chemical_name_mineral
- _chemical_name_structure_type
- _chemical_name_systematic
- _chemical_optical_rotation
- _chemical_properties_biological
- _chemical_properties_physical
- _chemical_temperature_decomposition
- _chemical_temperature_decomposition_gt
- _chemical_temperature_decomposition_lt
- _chemical_temperature_sublimation
- _chemical_temperature_sublimation_gt
- _chemical_temperature_sublimation_lt
- _chemical_conn_atom_[]
- _chemical_conn_atom_charge
- _chemical_conn_atom_display_x
- _chemical_conn_atom_display_y
- _chemical_conn_atom_NCA
- _chemical_conn_atom_NH
- _chemical_conn_atom_number
- _chemical_conn_atom_type_symbol
- _chemical_conn_bond_[]
- _chemical_formula_[]
- _chemical_formula_analytical
- _chemical_formula_iupac
- _chemical_formula_moiety
- _chemical_formula_structural
- _chemical_formula_sum
- _chemical_formula_weight
- _chemical_formula_weight_meas
- _citation_[]
- _citation_abstract
- _citation_abstract_id_CAS
- _citation_book_id_ISBN
- _citation_book_publisher
- _citation_book_publisher_city
- _citation_book_title
- _citation_coordinate_linkage
- _citation_country
- _citation_database_id_CSD
- _citation_database_id_Medline
- _citation_id
- _citation_journal_abbrev
- _citation_journal_id_ASTM
- _citation_journal_id_CSD
- _citation_journal_id_ISSN
- _citation_journal_full
- _citation_journal_issue
- _citation_journal_volume
- _citation_language
- _citation_page_first
- _citation_page_last
- _citation_special_details
- _citation_title
- _citation_year
- _citation_author_[]
- _citation_editor_[]
- _computing_[]
- _computing_cell_refinement
- _computing_data_collection
- _computing_data_reduction
- _computing_molecular_graphics
- _computing_publication_material
- _computing_structure_refinement
- _computing_structure_solution
- _database_[]
- _database_code_CAS
- _database_code_CSD
- _database_code_ICSD
- _database_code_MDF
- _database_code_NBS
- _database_code_PDB
- _database_code_PDF
- _database_code_depnum_ccdc_fiz
- _database_code_depnum_ccdc_journal
- _database_code_depnum_ccdc_archive
- _database_CSD_history
- _database_journal_ASTM
- _database_journal_CSD
- _diffrn_[]
- _diffrn_ambient_environment
- _diffrn_ambient_pressure
- _diffrn_ambient_pressure_gt
- _diffrn_ambient_pressure_lt
- _diffrn_ambient_temperature
- _diffrn_ambient_temperature_gt
- _diffrn_ambient_temperature_lt
- _diffrn_crystal_treatment
- _diffrn_measured_fraction_theta_full
- _diffrn_measured_fraction_theta_max
- _diffrn_special_details
- _diffrn_symmetry_description
- _diffrn_attenuator_[]
- _diffrn_detector_[]
- _diffrn_detector
- _diffrn_detector_area_resol_mean
- _diffrn_detector_details
- _diffrn_detector_dtime
- _diffrn_detector_type
- _diffrn_radiation_detector
- _diffrn_radiation_detector_dtime
- _diffrn_measurement_[]
- _diffrn_measurement_details
- _diffrn_measurement_device
- _diffrn_measurement_device_details
- _diffrn_measurement_device_type
- _diffrn_measurement_method
- _diffrn_measurement_specimen_support
- _diffrn_orient_matrix_[]
- _diffrn_orient_matrix_type
- _diffrn_orient_matrix_UB_11
- _diffrn_orient_matrix_UB_12
- _diffrn_orient_matrix_UB_13
- _diffrn_orient_matrix_UB_21
- _diffrn_orient_matrix_UB_22
- _diffrn_orient_matrix_UB_23
- _diffrn_orient_matrix_UB_31
- _diffrn_orient_matrix_UB_32
- _diffrn_orient_matrix_UB_33
- _diffrn_orient_refln_[]
- _diffrn_orient_refln_angle_chi
- _diffrn_orient_refln_angle_kappa
- _diffrn_orient_refln_angle_omega
- _diffrn_orient_refln_angle_phi
- _diffrn_orient_refln_angle_psi
- _diffrn_orient_refln_angle_theta
- _diffrn_orient_refln_index_h
- _diffrn_orient_refln_index_k
- _diffrn_orient_refln_index_l
- _diffrn_radiation_[]
- _diffrn_radiation_collimation
- _diffrn_radiation_filter_edge
- _diffrn_radiation_inhomogeneity
- _diffrn_radiation_monochromator
- _diffrn_radiation_polarisn_norm
- _diffrn_radiation_polarisn_ratio
- _diffrn_radiation_probe
- _diffrn_radiation_type
- _diffrn_radiation_xray_symbol
- _diffrn_radiation_wavelength_[]
- _diffrn_refln_[]
- _diffrn_refln_angle_chi
- _diffrn_refln_angle_kappa
- _diffrn_refln_angle_omega
- _diffrn_refln_angle_phi
- _diffrn_refln_angle_psi
- _diffrn_refln_angle_theta
- _diffrn_refln_attenuator_code
- _diffrn_refln_class_code
- _diffrn_refln_counts_bg_1
- _diffrn_refln_counts_bg_2
- _diffrn_refln_counts_net
- _diffrn_refln_counts_peak
- _diffrn_refln_counts_total
- _diffrn_refln_crystal_id
- _diffrn_refln_detect_slit_horiz
- _diffrn_refln_detect_slit_vert
- _diffrn_refln_elapsed_time
- _diffrn_refln_index_h
- _diffrn_refln_index_k
- _diffrn_refln_index_l
- _diffrn_refln_intensity_net
- _diffrn_refln_intensity_sigma
- _diffrn_refln_intensity_u
- _diffrn_refln_scale_group_code
- _diffrn_refln_scan_mode
- _diffrn_refln_scan_mode_backgd
- _diffrn_refln_scan_rate
- _diffrn_refln_scan_time_backgd
- _diffrn_refln_scan_width
- _diffrn_refln_sint/lambda
- _diffrn_refln_standard_code
- _diffrn_refln_wavelength
- _diffrn_refln_wavelength_id
- _diffrn_reflns_[]
- _diffrn_reflns_av_R_equivalents
- _diffrn_reflns_av_sigmaI/netI
- _diffrn_reflns_av_unetI/netI
- _diffrn_reflns_limit_h_max
- _diffrn_reflns_limit_h_min
- _diffrn_reflns_limit_k_max
- _diffrn_reflns_limit_k_min
- _diffrn_reflns_limit_l_max
- _diffrn_reflns_limit_l_min
- _diffrn_reflns_number
- _diffrn_reflns_reduction_process
- _diffrn_reflns_resolution_full
- _diffrn_reflns_resolution_max
- _diffrn_reflns_theta_full
- _diffrn_reflns_theta_max
- _diffrn_reflns_theta_min
- _diffrn_reflns_transf_matrix_11
- _diffrn_reflns_transf_matrix_12
- _diffrn_reflns_transf_matrix_13
- _diffrn_reflns_transf_matrix_21
- _diffrn_reflns_transf_matrix_22
- _diffrn_reflns_transf_matrix_23
- _diffrn_reflns_transf_matrix_31
- _diffrn_reflns_transf_matrix_32
- _diffrn_reflns_transf_matrix_33
- _diffrn_reflns_class_[]
- _diffrn_reflns_class_av_R_eq
- _diffrn_reflns_class_av_sgI/I
- _diffrn_reflns_class_av_uI/I
- _diffrn_reflns_class_code
- _diffrn_reflns_class_description
- _diffrn_reflns_class_d_res_high
- _diffrn_reflns_class_d_res_low
- _diffrn_reflns_class_number
- _diffrn_scale_group_[]
- _diffrn_source_[]
- _diffrn_radiation_source
- _diffrn_source
- _diffrn_source_current
- _diffrn_source_details
- _diffrn_source_power
- _diffrn_source_size
- _diffrn_source_take-off_angle
- _diffrn_source_target
- _diffrn_source_type
- _diffrn_source_voltage
- _diffrn_standard_refln_[]
- _diffrn_standard_refln_code
- _diffrn_standard_refln_index_h
- _diffrn_standard_refln_index_k
- _diffrn_standard_refln_index_l
- _diffrn_standards_[]
- _diffrn_standards_decay_%
- _diffrn_standards_interval_count
- _diffrn_standards_interval_time
- _diffrn_standards_number
- _diffrn_standards_scale_sigma
- _diffrn_standards_scale_u
- _exptl_[]
- _exptl_absorpt_coefficient_mu
- _exptl_absorpt_correction_T_max
- _exptl_absorpt_correction_T_min
- _exptl_absorpt_correction_type
- _exptl_absorpt_process_details
- _exptl_crystals_number
- _exptl_special_details
- _exptl_crystal_[]
- _exptl_crystal_colour
- _exptl_crystal_colour_lustre
- _exptl_crystal_colour_modifier
- _exptl_crystal_colour_primary
- _exptl_crystal_density_diffrn
- _exptl_crystal_density_meas
- _exptl_crystal_density_meas_gt
- _exptl_crystal_density_meas_lt
- _exptl_crystal_density_meas_temp
- _exptl_crystal_density_meas_temp_gt
- _exptl_crystal_density_meas_temp_lt
- _exptl_crystal_density_method
- _exptl_crystal_description
- _exptl_crystal_F_000
- _exptl_crystal_id
- _exptl_crystal_preparation
- _exptl_crystal_pressure_history
- _exptl_crystal_recrystallization_method
- _exptl_crystal_size_length
- _exptl_crystal_size_max
- _exptl_crystal_size_mid
- _exptl_crystal_size_min
- _exptl_crystal_size_rad
- _exptl_crystal_thermal_history
- _exptl_crystal_face_[]
- _exptl_crystal_face_diffr_chi
- _exptl_crystal_face_diffr_kappa
- _exptl_crystal_face_diffr_phi
- _exptl_crystal_face_diffr_psi
- _exptl_crystal_face_index_h
- _exptl_crystal_face_index_k
- _exptl_crystal_face_index_l
- _exptl_crystal_face_perp_dist
- _geom_[]
- _geom_angle_[]
- _geom_angle
- _geom_angle_atom_site_label_1
- _geom_angle_atom_site_label_2
- _geom_angle_atom_site_label_3
- _geom_angle_publ_flag
- _geom_angle_site_symmetry_1
- _geom_angle_site_symmetry_2
- _geom_angle_site_symmetry_3
- _geom_bond_[]
- _geom_bond_atom_site_label_1
- _geom_bond_atom_site_label_2
- _geom_bond_distance
- _geom_bond_publ_flag
- _geom_bond_site_symmetry_1
- _geom_bond_site_symmetry_2
- _geom_bond_valence
- _geom_contact_[]
- _geom_contact_atom_site_label_1
- _geom_contact_atom_site_label_2
- _geom_contact_distance
- _geom_contact_publ_flag
- _geom_contact_site_symmetry_1
- _geom_contact_site_symmetry_2
- _geom_hbond_[]
- _geom_hbond_angle_DHA
- _geom_hbond_atom_site_label_D
- _geom_hbond_atom_site_label_H
- _geom_hbond_atom_site_label_A
- _geom_hbond_distance_DH
- _geom_hbond_distance_HA
- _geom_hbond_distance_DA
- _geom_hbond_publ_flag
- _geom_hbond_site_symmetry_D
- _geom_hbond_site_symmetry_H
- _geom_hbond_site_symmetry_A
- _geom_torsion_[]
- _geom_torsion
- _geom_torsion_atom_site_label_1
- _geom_torsion_atom_site_label_2
- _geom_torsion_atom_site_label_3
- _geom_torsion_atom_site_label_4
- _geom_torsion_publ_flag
- _geom_torsion_site_symmetry_1
- _geom_torsion_site_symmetry_2
- _geom_torsion_site_symmetry_3
- _geom_torsion_site_symmetry_4
- _journal_[]
- _journal_coden_ASTM
- _journal_coden_Cambridge
- _journal_coeditor_address
- _journal_coeditor_code
- _journal_coeditor_email
- _journal_coeditor_fax
- _journal_coeditor_name
- _journal_coeditor_notes
- _journal_coeditor_phone
- _journal_data_validation_number
- _journal_date_accepted
- _journal_date_from_coeditor
- _journal_date_to_coeditor
- _journal_date_printers_final
- _journal_date_printers_first
- _journal_date_proofs_in
- _journal_date_proofs_out
- _journal_date_recd_copyright
- _journal_date_recd_electronic
- _journal_date_recd_hard_copy
- _journal_issue
- _journal_language
- _journal_name_full
- _journal_page_first
- _journal_page_last
- _journal_paper_category
- _journal_suppl_publ_number
- _journal_suppl_publ_pages
- _journal_techeditor_address
- _journal_techeditor_code
- _journal_techeditor_email
- _journal_techeditor_fax
- _journal_techeditor_name
- _journal_techeditor_notes
- _journal_techeditor_phone
- _journal_volume
- _journal_year
- _journal_index_[]
- _publ_[]
- _publ_contact_author
- _publ_contact_author_address
- _publ_contact_author_email
- _publ_contact_author_fax
- _publ_contact_author_id_iucr
- _publ_contact_author_name
- _publ_contact_author_phone
- _publ_contact_letter
- _publ_manuscript_creation
- _publ_manuscript_processed
- _publ_manuscript_text
- _publ_requested_category
- _publ_requested_coeditor_name
- _publ_requested_journal
- _publ_section_title
- _publ_section_title_footnote
- _publ_section_synopsis
- _publ_section_abstract
- _publ_section_comment
- _publ_section_introduction
- _publ_section_experimental
- _publ_section_exptl_prep
- _publ_section_exptl_refinement
- _publ_section_exptl_solution
- _publ_section_discussion
- _publ_section_acknowledgements
- _publ_section_references
- _publ_section_figure_captions
- _publ_section_table_legends
- _publ_author_[]
- _publ_body_[]
- _publ_manuscript_incl_[]
- _refine_[]
- _refine_diff_density_max
- _refine_diff_density_min
- _refine_diff_density_rms
- _refine_ls_abs_structure_details
- _refine_ls_abs_structure_Flack
- _refine_ls_abs_structure_Rogers
- _refine_ls_d_res_high
- _refine_ls_d_res_low
- _refine_ls_extinction_coef
- _refine_ls_extinction_expression
- _refine_ls_extinction_method
- _refine_ls_goodness_of_fit_all
- _refine_ls_goodness_of_fit_gt
- _refine_ls_goodness_of_fit_obs
- _refine_ls_goodness_of_fit_ref
- _refine_ls_hydrogen_treatment
- _refine_ls_matrix_type
- _refine_ls_number_constraints
- _refine_ls_number_parameters
- _refine_ls_number_reflns
- _refine_ls_number_restraints
- _refine_ls_R_factor_all
- _refine_ls_R_factor_gt
- _refine_ls_R_factor_obs
- _refine_ls_R_Fsqd_factor
- _refine_ls_R_I_factor
- _refine_ls_restrained_S_all
- _refine_ls_restrained_S_gt
- _refine_ls_restrained_S_obs
- _refine_ls_shift/esd_max
- _refine_ls_shift/esd_mean
- _refine_ls_shift/su_max
- _refine_ls_shift/su_max_lt
- _refine_ls_shift/su_mean
- _refine_ls_shift/su_mean_lt
- _refine_ls_structure_factor_coef
- _refine_ls_weighting_details
- _refine_ls_weighting_scheme
- _refine_ls_wR_factor_all
- _refine_ls_wR_factor_gt
- _refine_ls_wR_factor_obs
- _refine_ls_wR_factor_ref
- _refine_special_details
- _refine_ls_class_[]
- _refine_ls_class_code
- _refine_ls_class_d_res_high
- _refine_ls_class_d_res_low
- _refine_ls_class_R_factor_all
- _refine_ls_class_R_factor_gt
- _refine_ls_class_R_Fsqd_factor
- _refine_ls_class_R_I_factor
- _refine_ls_class_wR_factor_all
- _refln_[]
- _refln_A_calc
- _refln_A_meas
- _refln_B_calc
- _refln_B_meas
- _refln_class_code
- _refln_d_spacing
- _refln_crystal_id
- _refln_F_calc
- _refln_F_meas
- _refln_F_sigma
- _refln_F_squared_calc
- _refln_F_squared_meas
- _refln_F_squared_sigma
- _refln_include_status
- _refln_index_h
- _refln_index_k
- _refln_index_l
- _refln_intensity_calc
- _refln_intensity_meas
- _refln_intensity_sigma
- _refln_mean_path_length_tbar
- _refln_observed_status
- _refln_phase_calc
- _refln_phase_meas
- _refln_refinement_status
- _refln_scale_group_code
- _refln_sint/lambda
- _refln_symmetry_epsilon
- _refln_symmetry_multiplicity
- _refln_wavelength
- _refln_wavelength_id
- _reflns_[]
- _reflns_d_resolution_high
- _reflns_d_resolution_low
- _reflns_Friedel_coverage
- _reflns_limit_h_max
- _reflns_limit_h_min
- _reflns_limit_k_max
- _reflns_limit_k_min
- _reflns_limit_l_max
- _reflns_limit_l_min
- _reflns_number_gt
- _reflns_number_observed
- _reflns_number_total
- _reflns_observed_criterion
- _reflns_special_details
- _reflns_threshold_expression
- _reflns_class_[]
- _reflns_class_code
- _reflns_class_description
- _reflns_class_d_res_high
- _reflns_class_d_res_low
- _reflns_class_number_gt
- _reflns_class_number_total
- _reflns_class_R_factor_all
- _reflns_class_R_factor_gt
- _reflns_class_R_Fsqd_factor
- _reflns_class_R_I_factor
- _reflns_class_wR_factor_all
- _reflns_scale_[]
- _reflns_scale_group_code
- _reflns_scale_meas_F
- _reflns_scale_meas_F_squared
- _reflns_scale_meas_intensity
- _reflns_shell_[]
- _reflns_shell_d_res_high
- _reflns_shell_d_res_low
- _reflns_shell_meanI_over_sigI_all
- _reflns_shell_meanI_over_sigI_gt
- _reflns_shell_meanI_over_sigI_obs
- _reflns_shell_meanI_over_uI_all
- _reflns_shell_meanI_over_uI_gt
- _reflns_shell_number_measured_all
- _reflns_shell_number_measured_gt
- _reflns_shell_number_measured_obs
- _reflns_shell_number_possible
- _reflns_shell_number_unique_all
- _reflns_shell_number_unique_gt
- _reflns_shell_number_unique_obs
- _reflns_shell_percent_possible_all
- _reflns_shell_percent_possible_gt
- _reflns_shell_percent_possible_obs
- _reflns_shell_Rmerge_F_all
- _reflns_shell_Rmerge_F_gt
- _reflns_shell_Rmerge_F_obs
- _reflns_shell_Rmerge_I_all
- _reflns_shell_Rmerge_I_gt
- _reflns_shell_Rmerge_I_obs
- _space_group_[]
- _space_group_crystal_system
- _space_group_id
- _space_group_IT_number
- _space_group_name_Hall
- _space_group_name_H-M_alt
- _space_group_symop_[]
- _symmetry_[]
- _symmetry_cell_setting
- _symmetry_Int_Tables_number
- _symmetry_space_group_name_Hall
- _symmetry_space_group_name_H-M
- _symmetry_equiv_[]
- _valence_param_[]
- _valence_param_atom_1
- _valence_param_atom_1_valence
- _valence_param_atom_2
- _valence_param_atom_2_valence
- _valence_param_B
- _valence_param_details
- _valence_param_id
- _valence_param_ref_id
- _valence_param_Ro
- _valence_ref_[]
