data_PCOD1532902
_publ_section_title
;
Structure prediction by GRINSP 2.00 - 2006 (A. Le Bail)
VB5O10         PCOD1532902 R =  0.0122
Probable space group: P M A 2
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_chemical_formula_sum  "V B5 O10"
_cell_formula_units_Z    2
_cell_length_a          7.0543
_cell_length_b         18.3287
_cell_length_c         11.2913
_cell_angle_alpha     90.000
_cell_angle_beta      90.000
_cell_angle_gamma     90.000
_cell_volume          1459.92
_symmetry_space_group_name_H-M   "P 1"
_symmetry_Int_Tables_number  1
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
B1      0.03039   0.50208   0.70312
B2      0.47854   0.50011   0.70391
B3     -0.07191   0.63688   0.68870
B4      0.06222  -0.63487   0.68469
B5      0.43262  -0.63550   0.68548
B6      0.56814   0.63468   0.68359
V7     -0.00118   0.50185   0.97729
V8      0.49815   0.50145   0.97875
B9      0.06694   0.34270   0.91320
B10     -0.07651  -0.34097   0.91778
B11      0.55621  -0.34159   0.91284
B12      0.43215   0.34250   0.91505
O1     -0.02029   0.56753   0.65295
O2      0.07079   0.50445   0.82205
O3     -0.00298   0.43409   0.65565
O4      0.52301   0.56452   0.64856
O5      0.43344   0.50305   0.82218
O6      0.50155   0.43225   0.65406
O7     -0.25169   0.65773   0.65336
O8     -0.01986   0.65972   0.80056
O9      0.24760  -0.64906   0.65179
O10      0.01459  -0.66103   0.79556
O11      0.48156  -0.66047   0.79681
O12      0.50717   0.65567   0.79471
O13      0.24792   0.50097   1.02070
O14     -0.00135   0.40230   0.97419
O15     -0.25135   0.50125   1.01963
O16     -0.00439   0.60145   0.98262
O17      0.49931   0.40182   0.97707
O18      0.49351   0.60106   0.98184
O19      0.24895   0.32097   0.94037
O20     -0.26109  -0.31940   0.93771
#
#_symmetry_space_group_name_H-M  P M A 2
#_symmetry_Int_Tables_number   28
#
#   Starting Wyckoff positions:
#
#    1     2b     0.0000   0.5000   0.6600
#    2     4d    -0.0614   0.6558   0.6637
#    3     2b     0.0000   0.5000   0.9456
#    4     4d     0.0300   0.3181   0.9419
#
#   Coordination Sequence :
#
# PCOD1532902 VB5O10          R =  0.0122   28
#   4
#   2  4  2  4
#    3   6   8  10  12  12  12  12   0   0
#    3   4   5   7   9  11  12  12   0   0
#    5  10  12  12  12  12  12  12   0   0
#    3   5   8  11  12  12  12  12   0   0
#
#_framework_density    8.22
#
