# generated using pymatgen
data_CrH20C18(NO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.28072459
_cell_length_b   9.65255207
_cell_length_c   10.51140122
_cell_angle_alpha   68.61915719
_cell_angle_beta   75.71573116
_cell_angle_gamma   83.37207256
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CrH20C18(NO2)4
_chemical_formula_sum   'Cr1 H20 C18 N4 O8'
_cell_volume   483.30023943
_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
  Cr  Cr0  1  0.49999788  1.00000066  0.50000023  1
  H  H1  1  0.29275695  0.97034704  0.32242296  1
  H  H2  1  0.70723910  0.02965320  0.67757752  1
  H  H3  1  0.07233123  0.88439990  0.46849674  1
  H  H4  1  0.92766453  0.11560143  0.53150363  1
  H  H5  1  0.02534834  0.30899182  0.13567756  1
  H  H6  1  0.97465889  0.69100450  0.86432366  1
  H  H7  1  0.36049710  0.41455592  0.91935785  1
  H  H8  1  0.63951086  0.58544017  0.08064401  1
  H  H9  1  0.07286632  0.19432863  0.71060950  1
  H  H10  1  0.92712984  0.80567666  0.28938848  1
  H  H11  1  0.71347052  0.08674745  0.91596889  1
  H  H12  1  0.28652637  0.91325726  0.08402939  1
  H  H13  1  0.52190811  0.26018342  0.65313536  1
  H  H14  1  0.47809286  0.73981611  0.34686550  1
  H  H15  1  0.60951250  0.38637906  0.72165282  1
  H  H16  1  0.39048834  0.61362331  0.27834489  1
  H  H17  1  0.32239004  0.58338798  0.59203162  1
  H  H18  1  0.67760789  0.41661115  0.40796474  1
  H  H19  1  0.21202739  0.45601953  0.53422286  1
  H  H20  1  0.78797359  0.54397670  0.46577563  1
  C  C21  1  0.73345677  0.70597184  0.64873657  1
  C  C22  1  0.26653841  0.29402821  0.35126580  1
  C  C23  1  0.65028682  0.10509144  0.18089741  1
  C  C24  1  0.34971253  0.89490953  0.81910243  1
  C  C25  1  0.84031418  0.18406143  0.04816683  1
  C  C26  1  0.15968592  0.81593988  0.95183318  1
  C  C27  1  0.02224637  0.28144813  0.04455577  1
  C  C28  1  0.97775761  0.71855060  0.95544481  1
  C  C29  1  0.21325061  0.34083673  0.92540146  1
  C  C30  1  0.78675424  0.65916186  0.07459917  1
  C  C31  1  0.04786956  0.21739025  0.80713061  1
  C  C32  1  0.95212838  0.78261352  0.19286812  1
  C  C33  1  0.85069877  0.15836036  0.92332745  1
  C  C34  1  0.14929932  0.84164316  0.07667140  1
  C  C35  1  0.45236544  0.35573386  0.68626749  1
  C  C36  1  0.54763532  0.64426671  0.31373168  1
  C  C37  1  0.38200762  0.48411471  0.56239583  1
  C  C38  1  0.61799204  0.51588346  0.43760231  1
  N  N39  1  0.73818388  0.81238526  0.54192232  1
  N  N40  1  0.26181119  0.18761492  0.45808018  1
  N  N41  1  0.23184272  0.30467292  0.80959435  1
  N  N42  1  0.76815828  0.69532863  0.19040511  1
  O  O43  1  0.71553764  0.08545597  0.29777602  1
  O  O44  1  0.28445953  0.91454522  0.70222441  1
  O  O45  1  0.44247250  0.05976228  0.17250581  1
  O  O46  1  0.55752829  0.94023811  0.82749365  1
  O  O47  1  0.26054017  0.90879806  0.42776228  1
  O  O48  1  0.73945525  0.09120316  0.57223810  1
  O  O49  1  0.73646639  0.59955197  0.75258598  1
  O  O50  1  0.26352901  0.40044665  0.24741553  1
