The material structure described by ScRuGe2 crystallizes in the orthorhombic Pbam space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 12-coordinate geometry to one Ru(2), three equivalent Ru(1), one Ge(4), one Ge(5), two equivalent Ge(1), two equivalent Ge(2), and two equivalent Ge(3) atoms. In the second Sc site, Sc(2) is bonded in a 7-coordinate geometry to two equivalent Ru(2), four equivalent Ru(1), two equivalent Ge(1), two equivalent Ge(3), and three equivalent Ge(5) atoms. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded in a 12-coordinate geometry to two equivalent Sc(2), three equivalent Sc(1), one Ru(2), one Ge(2), one Ge(3), one Ge(4), one Ge(5), and two equivalent Ge(1) atoms. In the second Ru site, Ru(2) is bonded in a 12-coordinate geometry to two equivalent Sc(1), two equivalent Sc(2), two equivalent Ru(1), two equivalent Ge(1), two equivalent Ge(4), and two equivalent Ge(5) atoms. There are five inequivalent Ge sites. In the first Ge site, Ge(5) is bonded in a 9-coordinate geometry to two equivalent Sc(1), three equivalent Sc(2), two equivalent Ru(1), and two equivalent Ru(2) atoms. In the second Ge site, Ge(1) is bonded in a 7-coordinate geometry to one Sc(2), two equivalent Sc(1), one Ru(2), two equivalent Ru(1), and one Ge(1) atom. In the third Ge site, Ge(2) is bonded in a 7-coordinate geometry to four equivalent Sc(1), two equivalent Ru(1), and one Ge(2) atom. In the fourth Ge site, Ge(3) is bonded in a 9-coordinate geometry to two equivalent Sc(2), four equivalent Sc(1), two equivalent Ru(1), and one Ge(3) atom. In the fifth Ge site, Ge(4) is bonded in a 6-coordinate geometry to two equivalent Sc(1), two equivalent Ru(1), and two equivalent Ru(2) atoms. is represented by the CIF card [CIF]
data_ScGe2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.177
_cell_length_b   9.372
_cell_length_c   10.432
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   799.457
_cell_formula_units_Z   12
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
  Sc  Sc0  1  0.241  0.824  0.450  1.0
  Sc  Sc1  1  0.241  0.176  0.550  1.0
  Sc  Sc2  1  0.759  0.324  0.050  1.0
  Sc  Sc3  1  0.759  0.676  0.950  1.0
  Sc  Sc4  1  0.759  0.176  0.550  1.0
  Sc  Sc5  1  0.759  0.824  0.450  1.0
  Sc  Sc6  1  0.241  0.676  0.950  1.0
  Sc  Sc7  1  0.241  0.324  0.050  1.0
  Sc  Sc8  1  0.000  0.835  0.178  1.0
  Sc  Sc9  1  0.000  0.165  0.822  1.0
  Sc  Sc10  1  0.000  0.335  0.322  1.0
  Sc  Sc11  1  0.000  0.665  0.678  1.0
  Ge  Ge12  1  0.345  0.839  0.180  1.0
  Ge  Ge13  1  0.345  0.161  0.820  1.0
  Ge  Ge14  1  0.655  0.339  0.320  1.0
  Ge  Ge15  1  0.655  0.661  0.680  1.0
  Ge  Ge16  1  0.655  0.161  0.820  1.0
  Ge  Ge17  1  0.655  0.839  0.180  1.0
  Ge  Ge18  1  0.345  0.661  0.680  1.0
  Ge  Ge19  1  0.345  0.339  0.320  1.0
  Ge  Ge20  1  0.500  0.537  0.117  1.0
  Ge  Ge21  1  0.500  0.463  0.883  1.0
  Ge  Ge22  1  0.500  0.037  0.383  1.0
  Ge  Ge23  1  0.500  0.963  0.617  1.0
  Ge  Ge24  1  0.000  0.537  0.118  1.0
  Ge  Ge25  1  0.000  0.463  0.882  1.0
  Ge  Ge26  1  0.000  0.037  0.382  1.0
  Ge  Ge27  1  0.000  0.963  0.618  1.0
  Ge  Ge28  1  0.500  0.630  0.404  1.0
  Ge  Ge29  1  0.500  0.370  0.596  1.0
  Ge  Ge30  1  0.500  0.130  0.096  1.0
  Ge  Ge31  1  0.500  0.870  0.904  1.0
  Ge  Ge32  1  0.000  0.633  0.398  1.0
  Ge  Ge33  1  0.000  0.367  0.602  1.0
  Ge  Ge34  1  0.000  0.133  0.102  1.0
  Ge  Ge35  1  0.000  0.867  0.898  1.0
  Ru  Ru36  1  0.249  0.589  0.238  1.0
  Ru  Ru37  1  0.249  0.411  0.762  1.0
  Ru  Ru38  1  0.751  0.089  0.262  1.0
  Ru  Ru39  1  0.751  0.911  0.738  1.0
  Ru  Ru40  1  0.751  0.411  0.762  1.0
  Ru  Ru41  1  0.751  0.589  0.238  1.0
  Ru  Ru42  1  0.249  0.911  0.738  1.0
  Ru  Ru43  1  0.249  0.089  0.262  1.0
  Ru  Ru44  1  0.246  0.500  0.500  1.0
  Ru  Ru45  1  0.754  0.000  0.000  1.0
  Ru  Ru46  1  0.754  0.500  0.500  1.0
  Ru  Ru47  1  0.246  0.000  0.000  1.0
[/CIF]
.
The material structure described by ScRuGe2 crystallizes in the orthorhombic Pbam space group. There are two inequivalent Sc sites. In the first Sc site, Sc(1) is bonded in a 12-coordinate geometry to one Ru(2), three equivalent Ru(1), one Ge(4), one Ge(5), two equivalent Ge(1), two equivalent Ge(2), and two equivalent Ge(3) atoms. In the second Sc site, Sc(2) is bonded in a 7-coordinate geometry to two equivalent Ru(2), four equivalent Ru(1), two equivalent Ge(1), two equivalent Ge(3), and three equivalent Ge(5) atoms. There are two inequivalent Ru sites. In the first Ru site, Ru(1) is bonded in a 12-coordinate geometry to two equivalent Sc(2), three equivalent Sc(1), one Ru(2), one Ge(2), one Ge(3), one Ge(4), one Ge(5), and two equivalent Ge(1) atoms. In the second Ru site, Ru(2) is bonded in a 12-coordinate geometry to two equivalent Sc(1), two equivalent Sc(2), two equivalent Ru(1), two equivalent Ge(1), two equivalent Ge(4), and two equivalent Ge(5) atoms. There are five inequivalent Ge sites. In the first Ge site, Ge(5) is bonded in a 9-coordinate geometry to two equivalent Sc(1), three equivalent Sc(2), two equivalent Ru(1), and two equivalent Ru(2) atoms. In the second Ge site, Ge(1) is bonded in a 7-coordinate geometry to one Sc(2), two equivalent Sc(1), one Ru(2), two equivalent Ru(1), and one Ge(1) atom. In the third Ge site, Ge(2) is bonded in a 7-coordinate geometry to four equivalent Sc(1), two equivalent Ru(1), and one Ge(2) atom. In the fourth Ge site, Ge(3) is bonded in a 9-coordinate geometry to two equivalent Sc(2), four equivalent Sc(1), two equivalent Ru(1), and one Ge(3) atom. In the fifth Ge site, Ge(4) is bonded in a 6-coordinate geometry to two equivalent Sc(1), two equivalent Ru(1), and two equivalent Ru(2) atoms. is represented by the CIF card [CIF]
data_ScGe2Ru
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.177
_cell_length_b   9.372
_cell_length_c   10.432
_cell_angle_alpha   90.000
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   799.457
_cell_formula_units_Z   12
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
  Sc  Sc0  1  0.241  0.824  0.450  1.0
  Sc  Sc1  1  0.241  0.176  0.550  1.0
  Sc  Sc2  1  0.759  0.324  0.050  1.0
  Sc  Sc3  1  0.759  0.676  0.950  1.0
  Sc  Sc4  1  0.759  0.176  0.550  1.0
  Sc  Sc5  1  0.759  0.824  0.450  1.0
  Sc  Sc6  1  0.241  0.676  0.950  1.0
  Sc  Sc7  1  0.241  0.324  0.050  1.0
  Sc  Sc8  1  0.000  0.835  0.178  1.0
  Sc  Sc9  1  0.000  0.165  0.822  1.0
  Sc  Sc10  1  0.000  0.335  0.322  1.0
  Sc  Sc11  1  0.000  0.665  0.678  1.0
  Ge  Ge12  1  0.345  0.839  0.180  1.0
  Ge  Ge13  1  0.345  0.161  0.820  1.0
  Ge  Ge14  1  0.655  0.339  0.320  1.0
  Ge  Ge15  1  0.655  0.661  0.680  1.0
  Ge  Ge16  1  0.655  0.161  0.820  1.0
  Ge  Ge17  1  0.655  0.839  0.180  1.0
  Ge  Ge18  1  0.345  0.661  0.680  1.0
  Ge  Ge19  1  0.345  0.339  0.320  1.0
  Ge  Ge20  1  0.500  0.537  0.117  1.0
  Ge  Ge21  1  0.500  0.463  0.883  1.0
  Ge  Ge22  1  0.500  0.037  0.383  1.0
  Ge  Ge23  1  0.500  0.963  0.617  1.0
  Ge  Ge24  1  0.000  0.537  0.118  1.0
  Ge  Ge25  1  0.000  0.463  0.882  1.0
  Ge  Ge26  1  0.000  0.037  0.382  1.0
  Ge  Ge27  1  0.000  0.963  0.618  1.0
  Ge  Ge28  1  0.500  0.630  0.404  1.0
  Ge  Ge29  1  0.500  0.370  0.596  1.0
  Ge  Ge30  1  0.500  0.130  0.096  1.0
  Ge  Ge31  1  0.500  0.870  0.904  1.0
  Ge  Ge32  1  0.000  0.633  0.398  1.0
  Ge  Ge33  1  0.000  0.367  0.602  1.0
  Ge  Ge34  1  0.000  0.133  0.102  1.0
  Ge  Ge35  1  0.000  0.867  0.898  1.0
  Ru  Ru36  1  0.249  0.589  0.238  1.0
  Ru  Ru37  1  0.249  0.411  0.762  1.0
  Ru  Ru38  1  0.751  0.089  0.262  1.0
  Ru  Ru39  1  0.751  0.911  0.738  1.0
  Ru  Ru40  1  0.751  0.411  0.762  1.0
  Ru  Ru41  1  0.751  0.589  0.238  1.0
  Ru  Ru42  1  0.249  0.911  0.738  1.0
  Ru  Ru43  1  0.249  0.089  0.262  1.0
  Ru  Ru44  1  0.246  0.500  0.500  1.0
  Ru  Ru45  1  0.754  0.000  0.000  1.0
  Ru  Ru46  1  0.754  0.500  0.500  1.0
  Ru  Ru47  1  0.246  0.000  0.000  1.0
[/CIF]
.