The compound described by Ba3Sr(MoO4)4 is Zircon-derived structured and crystallizes in the triclinic P1 space group. There are three inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(11), one O(13), one O(16), one O(4), one O(6), and one O(8) atom. In the second Ba site, Ba(2) is bonded in a 8-coordinate geometry to one O(12), one O(14), one O(15), one O(2), one O(3), one O(5), one O(7), and one O(9) atom. In the third Ba site, Ba(3) is bonded in a 8-coordinate geometry to one O(12), one O(14), one O(16), one O(2), one O(3), one O(5), one O(8), and one O(9) atom. Sr(1) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(11), one O(13), one O(15), one O(4), one O(6), and one O(7) atom. There are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to one O(1), one O(13), one O(15), and one O(3) atom. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to one O(14), one O(16), one O(2), and one O(4) atom. In the third Mo site, Mo(3) is bonded in a tetrahedral geometry to one O(11), one O(5), one O(7), and one O(9) atom. In the fourth Mo site, Mo(4) is bonded in a tetrahedral geometry to one O(10), one O(12), one O(6), and one O(8) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(2) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(1) atom. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(3) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(4) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Ba(2), one Sr(1), and one Mo(3) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to one Ba(1), one Ba(3), and one Mo(4) atom. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(3) atom. In the tenth O site, O(10) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(4) atom. In the eleventh O site, O(11) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(3) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(4) atom. In the thirteenth O site, O(13) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(1) atom. In the fourteenth O site, O(14) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(2) atom. In the fifteenth O site, O(15) is bonded in a 3-coordinate geometry to one Ba(2), one Sr(1), and one Mo(1) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to one Ba(1), one Ba(3), and one Mo(2) atom. is represented by the CIF card [CIF]
data_Ba3Sr(MoO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.636
_cell_length_b   7.558
_cell_length_c   10.984
_cell_angle_alpha   72.216
_cell_angle_beta   75.135
_cell_angle_gamma   68.109
_symmetry_Int_Tables_number   1
_cell_volume   408.025
_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
  Ba  Ba0  1  0.626  0.437  0.311  1.0
  Ba  Ba1  1  0.624  0.938  0.814  1.0
  Ba  Ba2  1  0.375  0.562  0.688  1.0
  Sr  Sr3  1  0.375  0.063  0.188  1.0
  Mo  Mo4  1  0.124  0.688  0.065  1.0
  Mo  Mo5  1  0.126  0.186  0.560  1.0
  Mo  Mo6  1  0.875  0.310  0.941  1.0
  Mo  Mo7  1  0.875  0.816  0.435  1.0
  O  O8  1  0.321  0.448  0.141  1.0
  O  O9  1  0.325  0.953  0.641  1.0
  O  O10  1  0.082  0.690  0.908  1.0
  O  O11  1  0.089  0.184  0.402  1.0
  O  O12  1  0.185  0.255  0.838  1.0
  O  O13  1  0.190  0.766  0.334  1.0
  O  O14  1  0.709  0.135  0.966  1.0
  O  O15  1  0.723  0.634  0.459  1.0
  O  O16  1  0.677  0.545  0.861  1.0
  O  O17  1  0.666  0.046  0.355  1.0
  O  O18  1  0.932  0.305  0.096  1.0
  O  O19  1  0.917  0.814  0.592  1.0
  O  O20  1  0.806  0.751  0.162  1.0
  O  O21  1  0.813  0.243  0.661  1.0
  O  O22  1  0.282  0.866  0.046  1.0
  O  O23  1  0.282  0.365  0.540  1.0
[/CIF]
.
The compound described by Ba3Sr(MoO4)4 is Zircon-derived structured and crystallizes in the triclinic P1 space group. There are three inequivalent Ba sites. In the first Ba site, Ba(1) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(11), one O(13), one O(16), one O(4), one O(6), and one O(8) atom. In the second Ba site, Ba(2) is bonded in a 8-coordinate geometry to one O(12), one O(14), one O(15), one O(2), one O(3), one O(5), one O(7), and one O(9) atom. In the third Ba site, Ba(3) is bonded in a 8-coordinate geometry to one O(12), one O(14), one O(16), one O(2), one O(3), one O(5), one O(8), and one O(9) atom. Sr(1) is bonded in a 8-coordinate geometry to one O(1), one O(10), one O(11), one O(13), one O(15), one O(4), one O(6), and one O(7) atom. There are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a tetrahedral geometry to one O(1), one O(13), one O(15), and one O(3) atom. In the second Mo site, Mo(2) is bonded in a tetrahedral geometry to one O(14), one O(16), one O(2), and one O(4) atom. In the third Mo site, Mo(3) is bonded in a tetrahedral geometry to one O(11), one O(5), one O(7), and one O(9) atom. In the fourth Mo site, Mo(4) is bonded in a tetrahedral geometry to one O(10), one O(12), one O(6), and one O(8) atom. There are sixteen inequivalent O sites. In the first O site, O(1) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(1) atom. In the second O site, O(2) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(2) atom. In the third O site, O(3) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(1) atom. In the fourth O site, O(4) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(2) atom. In the fifth O site, O(5) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(3) atom. In the sixth O site, O(6) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(4) atom. In the seventh O site, O(7) is bonded in a 3-coordinate geometry to one Ba(2), one Sr(1), and one Mo(3) atom. In the eighth O site, O(8) is bonded in a distorted single-bond geometry to one Ba(1), one Ba(3), and one Mo(4) atom. In the ninth O site, O(9) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(3) atom. In the tenth O site, O(10) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(4) atom. In the eleventh O site, O(11) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(3) atom. In the twelfth O site, O(12) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(4) atom. In the thirteenth O site, O(13) is bonded in a 3-coordinate geometry to one Ba(1), one Sr(1), and one Mo(1) atom. In the fourteenth O site, O(14) is bonded in a distorted single-bond geometry to one Ba(2), one Ba(3), and one Mo(2) atom. In the fifteenth O site, O(15) is bonded in a 3-coordinate geometry to one Ba(2), one Sr(1), and one Mo(1) atom. In the sixteenth O site, O(16) is bonded in a distorted single-bond geometry to one Ba(1), one Ba(3), and one Mo(2) atom. is represented by the CIF card [CIF]
data_Ba3Sr(MoO4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.636
_cell_length_b   7.558
_cell_length_c   10.984
_cell_angle_alpha   72.216
_cell_angle_beta   75.135
_cell_angle_gamma   68.109
_symmetry_Int_Tables_number   1
_cell_volume   408.025
_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
  Ba  Ba0  1  0.626  0.437  0.311  1.0
  Ba  Ba1  1  0.624  0.938  0.814  1.0
  Ba  Ba2  1  0.375  0.562  0.688  1.0
  Sr  Sr3  1  0.375  0.063  0.188  1.0
  Mo  Mo4  1  0.124  0.688  0.065  1.0
  Mo  Mo5  1  0.126  0.186  0.560  1.0
  Mo  Mo6  1  0.875  0.310  0.941  1.0
  Mo  Mo7  1  0.875  0.816  0.435  1.0
  O  O8  1  0.321  0.448  0.141  1.0
  O  O9  1  0.325  0.953  0.641  1.0
  O  O10  1  0.082  0.690  0.908  1.0
  O  O11  1  0.089  0.184  0.402  1.0
  O  O12  1  0.185  0.255  0.838  1.0
  O  O13  1  0.190  0.766  0.334  1.0
  O  O14  1  0.709  0.135  0.966  1.0
  O  O15  1  0.723  0.634  0.459  1.0
  O  O16  1  0.677  0.545  0.861  1.0
  O  O17  1  0.666  0.046  0.355  1.0
  O  O18  1  0.932  0.305  0.096  1.0
  O  O19  1  0.917  0.814  0.592  1.0
  O  O20  1  0.806  0.751  0.162  1.0
  O  O21  1  0.813  0.243  0.661  1.0
  O  O22  1  0.282  0.866  0.046  1.0
  O  O23  1  0.282  0.365  0.540  1.0
[/CIF]
.