The material described by (Mo4NO13)2(NO)2O2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two nitroxyl molecules, two water atoms, and one Mo4NO13 cluster. In the Mo4NO13 cluster, there are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 5-coordinate geometry to one O(1), one O(13), one O(2), one O(6), and two equivalent O(5) atoms. In the second Mo site, Mo(2) is bonded in a 5-coordinate geometry to one O(11), one O(12), one O(3), one O(4), one O(5), and one O(6) atom. In the third Mo site, Mo(3) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(4), one O(5), one O(7), and one O(9) atom. In the fourth Mo site, Mo(4) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(2), one O(3), one O(5), and one O(8) atom. N(1) is bonded in a single-bond geometry to one O(10) atom. There are thirteen inequivalent O sites. In the first O site, O(11) is bonded in a single-bond geometry to one Mo(2) atom. In the second O site, O(12) is bonded in a single-bond geometry to one Mo(2) atom. In the third O site, O(13) is bonded in a single-bond geometry to one Mo(1) atom. In the fourth O site, O(1) is bonded in a distorted water-like geometry to one Mo(1), one Mo(3), and one Mo(4) atom. In the fifth O site, O(2) is bonded in a trigonal non-coplanar geometry to one Mo(1), one Mo(3), and one Mo(4) atom. In the sixth O site, O(3) is bonded in a bent 120 degrees geometry to one Mo(2) and one Mo(4) atom. In the seventh O site, O(4) is bonded in a bent 120 degrees geometry to one Mo(2) and one Mo(3) atom. In the eighth O site, O(5) is bonded in a 5-coordinate geometry to one Mo(2), one Mo(3), one Mo(4), and two equivalent Mo(1) atoms. In the ninth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Mo(1) and one Mo(2) atom. In the tenth O site, O(7) is bonded in a single-bond geometry to one Mo(3) atom. In the eleventh O site, O(8) is bonded in a single-bond geometry to one Mo(4) atom. In the twelfth O site, O(9) is bonded in a single-bond geometry to one Mo(3) atom. In the thirteenth O site, O(10) is bonded in a distorted single-bond geometry to one Mo(4) and one N(1) atom. is represented by the CIF card [CIF]
data_Mo4N2O15
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.080
_cell_length_b   9.994
_cell_length_c   10.857
_cell_angle_alpha   113.063
_cell_angle_beta   97.931
_cell_angle_gamma   110.256
_symmetry_Int_Tables_number   1
_cell_volume   717.739
_cell_formula_units_Z   2
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
  Mo  Mo0  1  0.759  0.577  0.563  1.0
  Mo  Mo1  1  0.241  0.423  0.437  1.0
  Mo  Mo2  1  0.615  0.373  0.780  1.0
  Mo  Mo3  1  0.385  0.627  0.220  1.0
  Mo  Mo4  1  0.460  0.649  0.793  1.0
  Mo  Mo5  1  0.540  0.351  0.207  1.0
  Mo  Mo6  1  0.557  0.814  0.584  1.0
  Mo  Mo7  1  0.443  0.186  0.416  1.0
  N  N8  1  0.954  0.116  0.654  1.0
  N  N9  1  0.046  0.884  0.346  1.0
  N  N10  1  0.099  0.823  0.035  1.0
  N  N11  1  0.901  0.177  0.965  1.0
  O  O12  1  0.727  0.760  0.690  1.0
  O  O13  1  0.273  0.240  0.310  1.0
  O  O14  1  0.356  0.661  0.610  1.0
  O  O15  1  0.644  0.339  0.390  1.0
  O  O16  1  0.548  0.192  0.579  1.0
  O  O17  1  0.452  0.808  0.421  1.0
  O  O18  1  0.629  0.587  0.873  1.0
  O  O19  1  0.371  0.413  0.127  1.0
  O  O20  1  0.434  0.424  0.581  1.0
  O  O21  1  0.566  0.576  0.419  1.0
  O  O22  1  0.802  0.499  0.681  1.0
  O  O23  1  0.198  0.501  0.319  1.0
  O  O24  1  0.544  0.850  0.913  1.0
  O  O25  1  0.456  0.150  0.087  1.0
  O  O26  1  0.595  0.998  0.712  1.0
  O  O27  1  0.405  0.002  0.288  1.0
  O  O28  1  0.251  0.550  0.811  1.0
  O  O29  1  0.749  0.450  0.189  1.0
  O  O30  1  0.869  0.975  0.580  1.0
  O  O31  1  0.131  0.025  0.420  1.0
  O  O32  1  0.410  0.265  0.799  1.0
  O  O33  1  0.590  0.735  0.201  1.0
  O  O34  1  0.789  0.372  0.889  1.0
  O  O35  1  0.211  0.628  0.111  1.0
  O  O36  1  0.966  0.663  0.538  1.0
  O  O37  1  0.034  0.337  0.462  1.0
  O  O38  1  0.018  0.184  0.917  1.0
  O  O39  1  0.982  0.816  0.083  1.0
  O  O40  1  0.209  0.932  0.754  1.0
  O  O41  1  0.791  0.068  0.246  1.0
[/CIF]
.
The material described by (Mo4NO13)2(NO)2O2 is Indium-derived structured and crystallizes in the triclinic P-1 space group. The structure is zero-dimensional and consists of two nitroxyl molecules, two water atoms, and one Mo4NO13 cluster. In the Mo4NO13 cluster, there are four inequivalent Mo sites. In the first Mo site, Mo(1) is bonded in a 5-coordinate geometry to one O(1), one O(13), one O(2), one O(6), and two equivalent O(5) atoms. In the second Mo site, Mo(2) is bonded in a 5-coordinate geometry to one O(11), one O(12), one O(3), one O(4), one O(5), and one O(6) atom. In the third Mo site, Mo(3) is bonded in a 6-coordinate geometry to one O(1), one O(2), one O(4), one O(5), one O(7), and one O(9) atom. In the fourth Mo site, Mo(4) is bonded in a 6-coordinate geometry to one O(1), one O(10), one O(2), one O(3), one O(5), and one O(8) atom. N(1) is bonded in a single-bond geometry to one O(10) atom. There are thirteen inequivalent O sites. In the first O site, O(11) is bonded in a single-bond geometry to one Mo(2) atom. In the second O site, O(12) is bonded in a single-bond geometry to one Mo(2) atom. In the third O site, O(13) is bonded in a single-bond geometry to one Mo(1) atom. In the fourth O site, O(1) is bonded in a distorted water-like geometry to one Mo(1), one Mo(3), and one Mo(4) atom. In the fifth O site, O(2) is bonded in a trigonal non-coplanar geometry to one Mo(1), one Mo(3), and one Mo(4) atom. In the sixth O site, O(3) is bonded in a bent 120 degrees geometry to one Mo(2) and one Mo(4) atom. In the seventh O site, O(4) is bonded in a bent 120 degrees geometry to one Mo(2) and one Mo(3) atom. In the eighth O site, O(5) is bonded in a 5-coordinate geometry to one Mo(2), one Mo(3), one Mo(4), and two equivalent Mo(1) atoms. In the ninth O site, O(6) is bonded in a distorted bent 120 degrees geometry to one Mo(1) and one Mo(2) atom. In the tenth O site, O(7) is bonded in a single-bond geometry to one Mo(3) atom. In the eleventh O site, O(8) is bonded in a single-bond geometry to one Mo(4) atom. In the twelfth O site, O(9) is bonded in a single-bond geometry to one Mo(3) atom. In the thirteenth O site, O(10) is bonded in a distorted single-bond geometry to one Mo(4) and one N(1) atom. is represented by the CIF card [CIF]
data_Mo4N2O15
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.080
_cell_length_b   9.994
_cell_length_c   10.857
_cell_angle_alpha   113.063
_cell_angle_beta   97.931
_cell_angle_gamma   110.256
_symmetry_Int_Tables_number   1
_cell_volume   717.739
_cell_formula_units_Z   2
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
  Mo  Mo0  1  0.759  0.577  0.563  1.0
  Mo  Mo1  1  0.241  0.423  0.437  1.0
  Mo  Mo2  1  0.615  0.373  0.780  1.0
  Mo  Mo3  1  0.385  0.627  0.220  1.0
  Mo  Mo4  1  0.460  0.649  0.793  1.0
  Mo  Mo5  1  0.540  0.351  0.207  1.0
  Mo  Mo6  1  0.557  0.814  0.584  1.0
  Mo  Mo7  1  0.443  0.186  0.416  1.0
  N  N8  1  0.954  0.116  0.654  1.0
  N  N9  1  0.046  0.884  0.346  1.0
  N  N10  1  0.099  0.823  0.035  1.0
  N  N11  1  0.901  0.177  0.965  1.0
  O  O12  1  0.727  0.760  0.690  1.0
  O  O13  1  0.273  0.240  0.310  1.0
  O  O14  1  0.356  0.661  0.610  1.0
  O  O15  1  0.644  0.339  0.390  1.0
  O  O16  1  0.548  0.192  0.579  1.0
  O  O17  1  0.452  0.808  0.421  1.0
  O  O18  1  0.629  0.587  0.873  1.0
  O  O19  1  0.371  0.413  0.127  1.0
  O  O20  1  0.434  0.424  0.581  1.0
  O  O21  1  0.566  0.576  0.419  1.0
  O  O22  1  0.802  0.499  0.681  1.0
  O  O23  1  0.198  0.501  0.319  1.0
  O  O24  1  0.544  0.850  0.913  1.0
  O  O25  1  0.456  0.150  0.087  1.0
  O  O26  1  0.595  0.998  0.712  1.0
  O  O27  1  0.405  0.002  0.288  1.0
  O  O28  1  0.251  0.550  0.811  1.0
  O  O29  1  0.749  0.450  0.189  1.0
  O  O30  1  0.869  0.975  0.580  1.0
  O  O31  1  0.131  0.025  0.420  1.0
  O  O32  1  0.410  0.265  0.799  1.0
  O  O33  1  0.590  0.735  0.201  1.0
  O  O34  1  0.789  0.372  0.889  1.0
  O  O35  1  0.211  0.628  0.111  1.0
  O  O36  1  0.966  0.663  0.538  1.0
  O  O37  1  0.034  0.337  0.462  1.0
  O  O38  1  0.018  0.184  0.917  1.0
  O  O39  1  0.982  0.816  0.083  1.0
  O  O40  1  0.209  0.932  0.754  1.0
  O  O41  1  0.791  0.068  0.246  1.0
[/CIF]
.