The material described by HgBr3CH3CH3NH2 is Indium-derived structured and crystallizes in the monoclinic P2_1/m space group. The structure is zero-dimensional and consists of two 02329_fluka molecules, two methylammonium molecules, and two HgBr3 clusters. In each HgBr3 cluster, Hg(1) is bonded in a distorted trigonal planar geometry to one Br(1), one Br(2), and one Br(3) atom. There are three inequivalent Br sites. In the first Br site, Br(3) is bonded in a single-bond geometry to one Hg(1) atom. In the second Br site, Br(1) is bonded in a single-bond geometry to one Hg(1) atom. In the third Br site, Br(2) is bonded in a single-bond geometry to one Hg(1) atom. is represented by the CIF card [CIF]
data_HgH8C2Br3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.520
_cell_length_b   7.182
_cell_length_c   10.429
_cell_angle_alpha   82.414
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   484.043
_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
  Hg  Hg0  1  0.750  0.405  0.137  1.0
  Hg  Hg1  1  0.250  0.595  0.863  1.0
  H  H2  1  0.386  0.130  0.376  1.0
  H  H3  1  0.114  0.130  0.376  1.0
  H  H4  1  0.880  0.058  0.823  1.0
  H  H5  1  0.380  0.942  0.177  1.0
  H  H6  1  0.886  0.228  0.605  1.0
  H  H7  1  0.750  0.972  0.485  1.0
  H  H8  1  0.750  0.261  0.814  1.0
  H  H9  1  0.114  0.772  0.395  1.0
  H  H10  1  0.386  0.772  0.395  1.0
  H  H11  1  0.614  0.228  0.605  1.0
  H  H12  1  0.250  0.739  0.186  1.0
  H  H13  1  0.614  0.870  0.624  1.0
  H  H14  1  0.250  0.028  0.515  1.0
  H  H15  1  0.120  0.942  0.177  1.0
  H  H16  1  0.886  0.870  0.624  1.0
  H  H17  1  0.620  0.058  0.823  1.0
  C  C18  1  0.750  0.145  0.638  1.0
  C  C19  1  0.250  0.855  0.362  1.0
  C  C20  1  0.250  0.047  0.409  1.0
  C  C21  1  0.750  0.953  0.591  1.0
  Br  Br22  1  0.750  0.566  0.892  1.0
  Br  Br23  1  0.750  0.036  0.132  1.0
  Br  Br24  1  0.250  0.434  0.108  1.0
  Br  Br25  1  0.750  0.531  0.353  1.0
  Br  Br26  1  0.250  0.469  0.647  1.0
  Br  Br27  1  0.250  0.964  0.868  1.0
  N  N28  1  0.250  0.872  0.217  1.0
  N  N29  1  0.750  0.128  0.783  1.0
[/CIF]
.
The material described by HgBr3CH3CH3NH2 is Indium-derived structured and crystallizes in the monoclinic P2_1/m space group. The structure is zero-dimensional and consists of two 02329_fluka molecules, two methylammonium molecules, and two HgBr3 clusters. In each HgBr3 cluster, Hg(1) is bonded in a distorted trigonal planar geometry to one Br(1), one Br(2), and one Br(3) atom. There are three inequivalent Br sites. In the first Br site, Br(3) is bonded in a single-bond geometry to one Hg(1) atom. In the second Br site, Br(1) is bonded in a single-bond geometry to one Hg(1) atom. In the third Br site, Br(2) is bonded in a single-bond geometry to one Hg(1) atom. is represented by the CIF card [CIF]
data_HgH8C2Br3N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.520
_cell_length_b   7.182
_cell_length_c   10.429
_cell_angle_alpha   82.414
_cell_angle_beta   90.000
_cell_angle_gamma   90.000
_symmetry_Int_Tables_number   1
_cell_volume   484.043
_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
  Hg  Hg0  1  0.750  0.405  0.137  1.0
  Hg  Hg1  1  0.250  0.595  0.863  1.0
  H  H2  1  0.386  0.130  0.376  1.0
  H  H3  1  0.114  0.130  0.376  1.0
  H  H4  1  0.880  0.058  0.823  1.0
  H  H5  1  0.380  0.942  0.177  1.0
  H  H6  1  0.886  0.228  0.605  1.0
  H  H7  1  0.750  0.972  0.485  1.0
  H  H8  1  0.750  0.261  0.814  1.0
  H  H9  1  0.114  0.772  0.395  1.0
  H  H10  1  0.386  0.772  0.395  1.0
  H  H11  1  0.614  0.228  0.605  1.0
  H  H12  1  0.250  0.739  0.186  1.0
  H  H13  1  0.614  0.870  0.624  1.0
  H  H14  1  0.250  0.028  0.515  1.0
  H  H15  1  0.120  0.942  0.177  1.0
  H  H16  1  0.886  0.870  0.624  1.0
  H  H17  1  0.620  0.058  0.823  1.0
  C  C18  1  0.750  0.145  0.638  1.0
  C  C19  1  0.250  0.855  0.362  1.0
  C  C20  1  0.250  0.047  0.409  1.0
  C  C21  1  0.750  0.953  0.591  1.0
  Br  Br22  1  0.750  0.566  0.892  1.0
  Br  Br23  1  0.750  0.036  0.132  1.0
  Br  Br24  1  0.250  0.434  0.108  1.0
  Br  Br25  1  0.750  0.531  0.353  1.0
  Br  Br26  1  0.250  0.469  0.647  1.0
  Br  Br27  1  0.250  0.964  0.868  1.0
  N  N28  1  0.250  0.872  0.217  1.0
  N  N29  1  0.750  0.128  0.783  1.0
[/CIF]
.