The material described by SrC4(SO)4 crystallizes in the orthorhombic Pnma space group. Sr(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form edge-sharing SrO6 octahedra. There are two inequivalent C sites. In the first C site, C(1) is bonded in a distorted T-shaped geometry to one C(1), one C(2), and one S(1) atom. In the second C site, C(2) is bonded in a distorted T-shaped geometry to one C(1), one C(2), and one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a 1-coordinate geometry to one C(1) and one O(2) atom. In the second S site, S(2) is bonded in a distorted water-like geometry to one C(2) and one O(3) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a water-like geometry to two equivalent Sr(1) atoms. In the second O site, O(2) is bonded to two equivalent Sr(1) and two equivalent S(1) atoms to form corner-sharing OSr2S2 tetrahedra. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Sr(1) and one S(2) atom. is represented by the CIF card [CIF]
data_SrC4(SO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.024
_cell_length_b   11.148
_cell_length_c   11.319
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1012.515
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Sr  Sr0  1  0.675  0.263  0.750  1.0
  Sr  Sr1  1  0.175  0.237  0.750  1.0
  Sr  Sr2  1  0.325  0.737  0.250  1.0
  Sr  Sr3  1  0.825  0.763  0.250  1.0
  C  C4  1  0.957  0.598  0.813  1.0
  C  C5  1  0.457  0.902  0.687  1.0
  C  C6  1  0.043  0.402  0.313  1.0
  C  C7  1  0.543  0.098  0.187  1.0
  C  C8  1  0.043  0.402  0.187  1.0
  C  C9  1  0.543  0.098  0.313  1.0
  C  C10  1  0.957  0.598  0.687  1.0
  C  C11  1  0.457  0.902  0.813  1.0
  C  C12  1  0.938  0.729  0.815  1.0
  C  C13  1  0.438  0.771  0.685  1.0
  C  C14  1  0.062  0.271  0.315  1.0
  C  C15  1  0.562  0.229  0.185  1.0
  C  C16  1  0.062  0.271  0.185  1.0
  C  C17  1  0.562  0.229  0.315  1.0
  C  C18  1  0.938  0.729  0.685  1.0
  C  C19  1  0.438  0.771  0.815  1.0
  S  S20  1  0.959  0.470  0.897  1.0
  S  S21  1  0.459  0.030  0.603  1.0
  S  S22  1  0.041  0.530  0.397  1.0
  S  S23  1  0.541  0.970  0.103  1.0
  S  S24  1  0.041  0.530  0.103  1.0
  S  S25  1  0.541  0.970  0.397  1.0
  S  S26  1  0.959  0.470  0.603  1.0
  S  S27  1  0.459  0.030  0.897  1.0
  S  S28  1  0.907  0.835  0.915  1.0
  S  S29  1  0.407  0.665  0.585  1.0
  S  S30  1  0.093  0.165  0.415  1.0
  S  S31  1  0.593  0.335  0.085  1.0
  S  S32  1  0.093  0.165  0.085  1.0
  S  S33  1  0.593  0.335  0.415  1.0
  S  S34  1  0.907  0.835  0.585  1.0
  S  S35  1  0.407  0.665  0.915  1.0
  O  O36  1  0.414  0.389  0.750  1.0
  O  O37  1  0.914  0.111  0.750  1.0
  O  O38  1  0.586  0.611  0.250  1.0
  O  O39  1  0.086  0.889  0.250  1.0
  O  O40  1  0.941  0.391  0.750  1.0
  O  O41  1  0.441  0.109  0.750  1.0
  O  O42  1  0.059  0.609  0.250  1.0
  O  O43  1  0.559  0.891  0.250  1.0
  O  O44  1  0.105  0.225  0.964  1.0
  O  O45  1  0.605  0.275  0.536  1.0
  O  O46  1  0.895  0.775  0.464  1.0
  O  O47  1  0.395  0.725  0.036  1.0
  O  O48  1  0.895  0.775  0.036  1.0
  O  O49  1  0.395  0.725  0.464  1.0
  O  O50  1  0.105  0.225  0.536  1.0
  O  O51  1  0.605  0.275  0.964  1.0
[/CIF]
.
The material described by SrC4(SO)4 crystallizes in the orthorhombic Pnma space group. Sr(1) is bonded to two equivalent O(1), two equivalent O(2), and two equivalent O(3) atoms to form edge-sharing SrO6 octahedra. There are two inequivalent C sites. In the first C site, C(1) is bonded in a distorted T-shaped geometry to one C(1), one C(2), and one S(1) atom. In the second C site, C(2) is bonded in a distorted T-shaped geometry to one C(1), one C(2), and one S(2) atom. There are two inequivalent S sites. In the first S site, S(1) is bonded in a 1-coordinate geometry to one C(1) and one O(2) atom. In the second S site, S(2) is bonded in a distorted water-like geometry to one C(2) and one O(3) atom. There are three inequivalent O sites. In the first O site, O(1) is bonded in a water-like geometry to two equivalent Sr(1) atoms. In the second O site, O(2) is bonded to two equivalent Sr(1) and two equivalent S(1) atoms to form corner-sharing OSr2S2 tetrahedra. In the third O site, O(3) is bonded in a bent 150 degrees geometry to one Sr(1) and one S(2) atom. is represented by the CIF card [CIF]
data_SrC4(SO)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.024
_cell_length_b   11.148
_cell_length_c   11.319
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   1012.515
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Sr  Sr0  1  0.675  0.263  0.750  1.0
  Sr  Sr1  1  0.175  0.237  0.750  1.0
  Sr  Sr2  1  0.325  0.737  0.250  1.0
  Sr  Sr3  1  0.825  0.763  0.250  1.0
  C  C4  1  0.957  0.598  0.813  1.0
  C  C5  1  0.457  0.902  0.687  1.0
  C  C6  1  0.043  0.402  0.313  1.0
  C  C7  1  0.543  0.098  0.187  1.0
  C  C8  1  0.043  0.402  0.187  1.0
  C  C9  1  0.543  0.098  0.313  1.0
  C  C10  1  0.957  0.598  0.687  1.0
  C  C11  1  0.457  0.902  0.813  1.0
  C  C12  1  0.938  0.729  0.815  1.0
  C  C13  1  0.438  0.771  0.685  1.0
  C  C14  1  0.062  0.271  0.315  1.0
  C  C15  1  0.562  0.229  0.185  1.0
  C  C16  1  0.062  0.271  0.185  1.0
  C  C17  1  0.562  0.229  0.315  1.0
  C  C18  1  0.938  0.729  0.685  1.0
  C  C19  1  0.438  0.771  0.815  1.0
  S  S20  1  0.959  0.470  0.897  1.0
  S  S21  1  0.459  0.030  0.603  1.0
  S  S22  1  0.041  0.530  0.397  1.0
  S  S23  1  0.541  0.970  0.103  1.0
  S  S24  1  0.041  0.530  0.103  1.0
  S  S25  1  0.541  0.970  0.397  1.0
  S  S26  1  0.959  0.470  0.603  1.0
  S  S27  1  0.459  0.030  0.897  1.0
  S  S28  1  0.907  0.835  0.915  1.0
  S  S29  1  0.407  0.665  0.585  1.0
  S  S30  1  0.093  0.165  0.415  1.0
  S  S31  1  0.593  0.335  0.085  1.0
  S  S32  1  0.093  0.165  0.085  1.0
  S  S33  1  0.593  0.335  0.415  1.0
  S  S34  1  0.907  0.835  0.585  1.0
  S  S35  1  0.407  0.665  0.915  1.0
  O  O36  1  0.414  0.389  0.750  1.0
  O  O37  1  0.914  0.111  0.750  1.0
  O  O38  1  0.586  0.611  0.250  1.0
  O  O39  1  0.086  0.889  0.250  1.0
  O  O40  1  0.941  0.391  0.750  1.0
  O  O41  1  0.441  0.109  0.750  1.0
  O  O42  1  0.059  0.609  0.250  1.0
  O  O43  1  0.559  0.891  0.250  1.0
  O  O44  1  0.105  0.225  0.964  1.0
  O  O45  1  0.605  0.275  0.536  1.0
  O  O46  1  0.895  0.775  0.464  1.0
  O  O47  1  0.395  0.725  0.036  1.0
  O  O48  1  0.895  0.775  0.036  1.0
  O  O49  1  0.395  0.725  0.464  1.0
  O  O50  1  0.105  0.225  0.536  1.0
  O  O51  1  0.605  0.275  0.964  1.0
[/CIF]
.