data_0-TOPOS_EHULUP_lsz;sqc166
_database_code_CSD                  EHULUP
_audit_creation_date                12/23/2020
_audit_creation_method              ToposPro
_chemical_formula_structural        lsz;sqc166
_chemical_name_systematic
;
tetrakis(4-Di-isopropylhydroxysilylphenyl)methane hexane solvate. 
;
_chemical_formula_sum               ZA0
_citation_journal_abbrev            Organometallics
_citation_year                      2010
_citation_journal_volume            29
_citation_page_first                3281
_citation_special_details
;
File: E.cif. 
CENTAT: none
SIMPLIG: ZA=C49H76O4Si4 ZB=C6H14
SIMPPA
R: METH=Stand; INTRA=V; INTER=H| 
;
loop_
_publ_author_name
'Kawakami Y.'
'Sakuma Y.'
'Wakuda T.'
'Nakai T.'
'Shirasaka M.'
'Kabe Y.'
_cell_length_a                      12.591
_cell_length_b                      13.083
_cell_length_c                      17.732
_cell_angle_alpha                   90
_cell_angle_beta                    90.47
_cell_angle_gamma                   90
_cell_volume                        2920.86
_cell_formula_units_Z               2
_symmetry_space_group_name_H-M      'P n'
_symmetry_Int_Tables_number         7
_refine_ls_R_factor_all             0
loop_
_symmetry_equiv_pos_site_id
_symmetry_equiv_pos_as_xyz
1 x,y,z
2 1/2+x,-y,1/2+z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
ZA1 ZA 2 0.43961 0.16298 0.87750 1.0000
loop_
_topol_link.node_label_1
_topol_link.node_label_2
_topol_link.distance
_topol_link.site_symmetry_symop_1
_topol_link.site_symmetry_translation_1_x
_topol_link.site_symmetry_translation_1_y
_topol_link.site_symmetry_translation_1_z
_topol_link.site_symmetry_symop_2
_topol_link.site_symmetry_translation_2_x
_topol_link.site_symmetry_translation_2_y
_topol_link.site_symmetry_translation_2_z
_topol_link.type
_topol_link.multiplicity
ZA1 ZA1 11.7193 1 0 0 0 2 0 0 -1 v 2
ZA1 ZA1 13.9674 1 0 0 0 2 0 1 0 v 2
ZA1 ZA1 12.5910 1 0 0 0 1 1 0 0 v 2
ZA1 ZA1 13.0830 1 0 0 0 1 0 1 0 v 2
#End of data_0-TOPOS_EHULUP_lsz;sqc166