The material structure described by SrLa3Mn4O12 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2 space group. Sr(1) is bonded in a 12-coordinate geometry to two equivalent O(1), two equivalent O(2), two equivalent O(4), two equivalent O(5), two equivalent O(6), and two equivalent O(7) atoms. There are three inequivalent La sites. In the first La site, La(1) is bonded in a 9-coordinate geometry to one O(3), two equivalent O(1), two equivalent O(5), two equivalent O(6), and two equivalent O(8) atoms. In the second La site, La(2) is bonded in a 9-coordinate geometry to one O(8), two equivalent O(1), two equivalent O(2), two equivalent O(3), and two equivalent O(5) atoms. In the third La site, La(3) is bonded in a 9-coordinate geometry to one O(7), two equivalent O(1), two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(2), one O(3), one O(5), one O(6), and one O(7) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 15-21°. In the second Mn site, Mn(2) is bonded to one O(1), one O(2), one O(4), one O(5), one O(6), and one O(8) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 15-21°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Sr(1), one La(1), one La(2), one La(3), one Mn(1), and one Mn(2) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Sr(1), one La(2), one La(3), one Mn(1), and one Mn(2) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one La(1), two equivalent La(2), and two equivalent Mn(1) atoms. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to two equivalent Sr(1), two equivalent La(3), and two equivalent Mn(2) atoms. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Sr(1), one La(1), one La(2), one Mn(1), and one Mn(2) atom. In the sixth O site, O(6) is bonded in a 5-coordinate geometry to one Sr(1), one La(1), one La(3), one Mn(1), and one Mn(2) atom. In the seventh O site, O(7) is bonded in a 5-coordinate geometry to two equivalent Sr(1), one La(3), and two equivalent Mn(1) atoms. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one La(2), two equivalent La(1), and two equivalent Mn(2) atoms. is represented by the CIF card [CIF]
data_SrLa3Mn4O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.536
_cell_length_b   7.877
_cell_length_c   5.594
_cell_angle_alpha   89.993
_cell_angle_beta   90.295
_cell_angle_gamma   90.828
_symmetry_Int_Tables_number   1
_cell_volume   243.876
_cell_formula_units_Z   1
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  0.500  0.250  0.003  1.0
  La  La1  1  1.000  0.750  0.497  1.0
  La  La2  1  0.500  0.750  1.000  1.0
  La  La3  1  1.000  0.250  0.501  1.0
  Mn  Mn4  1  0.000  0.499  0.000  1.0
  Mn  Mn5  1  0.500  0.001  0.500  1.0
  Mn  Mn6  1  1.000  0.001  0.000  1.0
  Mn  Mn7  1  0.500  0.499  0.500  1.0
  O  O8  1  0.221  0.533  0.720  1.0
  O  O9  1  0.726  0.022  0.226  1.0
  O  O10  1  0.274  0.478  0.226  1.0
  O  O11  1  0.780  0.967  0.720  1.0
  O  O12  1  1.000  0.750  0.060  1.0
  O  O13  1  0.500  0.250  0.551  1.0
  O  O14  1  0.723  0.538  0.776  1.0
  O  O15  1  0.215  0.026  0.286  1.0
  O  O16  1  0.000  0.250  0.935  1.0
  O  O17  1  0.500  0.750  0.437  1.0
  O  O18  1  0.785  0.474  0.286  1.0
  O  O19  1  0.277  0.962  0.776  1.0
[/CIF]
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The material structure described by SrLa3Mn4O12 is Orthorhombic Perovskite-derived structured and crystallizes in the monoclinic P2 space group. Sr(1) is bonded in a 12-coordinate geometry to two equivalent O(1), two equivalent O(2), two equivalent O(4), two equivalent O(5), two equivalent O(6), and two equivalent O(7) atoms. There are three inequivalent La sites. In the first La site, La(1) is bonded in a 9-coordinate geometry to one O(3), two equivalent O(1), two equivalent O(5), two equivalent O(6), and two equivalent O(8) atoms. In the second La site, La(2) is bonded in a 9-coordinate geometry to one O(8), two equivalent O(1), two equivalent O(2), two equivalent O(3), and two equivalent O(5) atoms. In the third La site, La(3) is bonded in a 9-coordinate geometry to one O(7), two equivalent O(1), two equivalent O(2), two equivalent O(4), and two equivalent O(6) atoms. There are two inequivalent Mn sites. In the first Mn site, Mn(1) is bonded to one O(1), one O(2), one O(3), one O(5), one O(6), and one O(7) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 15-21°. In the second Mn site, Mn(2) is bonded to one O(1), one O(2), one O(4), one O(5), one O(6), and one O(8) atom to form corner-sharing MnO6 octahedra. The corner-sharing octahedral tilt angles range from 15-21°. There are eight inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Sr(1), one La(1), one La(2), one La(3), one Mn(1), and one Mn(2) atom. In the second O site, O(2) is bonded in a 2-coordinate geometry to one Sr(1), one La(2), one La(3), one Mn(1), and one Mn(2) atom. In the third O site, O(3) is bonded in a 3-coordinate geometry to one La(1), two equivalent La(2), and two equivalent Mn(1) atoms. In the fourth O site, O(4) is bonded in a 6-coordinate geometry to two equivalent Sr(1), two equivalent La(3), and two equivalent Mn(2) atoms. In the fifth O site, O(5) is bonded in a 3-coordinate geometry to one Sr(1), one La(1), one La(2), one Mn(1), and one Mn(2) atom. In the sixth O site, O(6) is bonded in a 5-coordinate geometry to one Sr(1), one La(1), one La(3), one Mn(1), and one Mn(2) atom. In the seventh O site, O(7) is bonded in a 5-coordinate geometry to two equivalent Sr(1), one La(3), and two equivalent Mn(1) atoms. In the eighth O site, O(8) is bonded in a 3-coordinate geometry to one La(2), two equivalent La(1), and two equivalent Mn(2) atoms. is represented by the CIF card [CIF]
data_SrLa3Mn4O12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.536
_cell_length_b   7.877
_cell_length_c   5.594
_cell_angle_alpha   89.993
_cell_angle_beta   90.295
_cell_angle_gamma   90.828
_symmetry_Int_Tables_number   1
_cell_volume   243.876
_cell_formula_units_Z   1
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  0.500  0.250  0.003  1.0
  La  La1  1  1.000  0.750  0.497  1.0
  La  La2  1  0.500  0.750  1.000  1.0
  La  La3  1  1.000  0.250  0.501  1.0
  Mn  Mn4  1  0.000  0.499  0.000  1.0
  Mn  Mn5  1  0.500  0.001  0.500  1.0
  Mn  Mn6  1  1.000  0.001  0.000  1.0
  Mn  Mn7  1  0.500  0.499  0.500  1.0
  O  O8  1  0.221  0.533  0.720  1.0
  O  O9  1  0.726  0.022  0.226  1.0
  O  O10  1  0.274  0.478  0.226  1.0
  O  O11  1  0.780  0.967  0.720  1.0
  O  O12  1  1.000  0.750  0.060  1.0
  O  O13  1  0.500  0.250  0.551  1.0
  O  O14  1  0.723  0.538  0.776  1.0
  O  O15  1  0.215  0.026  0.286  1.0
  O  O16  1  0.000  0.250  0.935  1.0
  O  O17  1  0.500  0.750  0.437  1.0
  O  O18  1  0.785  0.474  0.286  1.0
  O  O19  1  0.277  0.962  0.776  1.0
[/CIF]
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