# generated using pymatgen
data_Cr2CoH8C14(NO)6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.84773497
_cell_length_b   10.83061998
_cell_length_c   10.93588909
_cell_angle_alpha   88.77151632
_cell_angle_beta   88.74246727
_cell_angle_gamma   63.81379374
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cr2CoH8C14(NO)6
_chemical_formula_sum   'Cr4 Co2 H16 C28 N12 O12'
_cell_volume   1152.58652391
_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
  Cr  Cr0  1  0.90637268  0.08552826  0.24315636  1
  Cr  Cr1  1  0.09362540  0.91447224  0.75684303  1
  Co  Co2  1  0.85980607  0.97538516  -0.00882909  1
  Cr  Cr3  1  0.00537847  0.14637348  0.51176683  1
  Co  Co4  1  0.14019283  0.02461489  1.00882899  1
  Cr  Cr5  1  0.99461924  0.85362965  0.48823224  1
  H  H6  1  0.53454749  0.17222531  0.40887566  1
  H  H7  1  0.82964038  0.45124308  0.08977956  1
  H  H8  1  0.46545526  0.82776812  0.59112601  1
  H  H9  1  0.17036393  0.54875626  0.91021893  1
  H  H10  1  0.33258031  0.15580144  0.50863037  1
  H  H11  1  0.84027414  0.65417830  0.98710299  1
  H  H12  1  0.66741942  0.84419646  0.49137075  1
  H  H13  1  0.15973427  0.34582067  0.01289480  1
  H  H14  1  0.42225154  0.07623590  0.05748578  1
  H  H15  1  0.92245678  0.57211347  0.43898214  1
  H  H16  1  0.57775125  0.92375865  0.94251391  1
  H  H17  1  0.07753665  0.42788883  0.56101806  1
  H  H18  1  0.86813162  0.20695262  0.03771279  1
  H  H19  1  0.79387624  0.09576292  0.44846064  1
  H  H20  1  0.13186699  0.79304801  0.96228689  1
  H  H21  1  0.20612134  0.90423828  0.55153847  1
  C  C22  1  0.62599094  0.11236562  0.17230036  1
  C  C23  1  0.88512803  0.36553635  0.32680865  1
  C  C24  1  0.37400724  0.88763362  0.82770474  1
  C  C25  1  0.11486777  0.63446757  0.67318437  1
  C  C26  1  0.49671163  0.11665603  0.22823408  1
  C  C27  1  0.88146681  0.49375190  0.27011956  1
  C  C28  1  0.50328955  0.88333968  0.77176597  1
  C  C29  1  0.11853332  0.50625202  0.72988291  1
  C  C30  1  0.46734607  0.14444342  0.35484297  1
  C  C31  1  0.85441161  0.52129899  0.14289967  1
  C  C32  1  0.53265577  0.85555216  0.64515854  1
  C  C33  1  0.14559121  0.47870252  0.85709900  1
  C  C34  1  0.35473880  0.13623348  0.41142434  1
  C  C35  1  0.85961463  0.63453108  0.08455639  1
  C  C36  1  0.64526135  0.86376388  0.58857645  1
  C  C37  1  0.14038987  0.36546749  0.91544058  1
  C  C38  1  0.27054360  0.10039242  0.33934712  1
  C  C39  1  0.89124491  0.72317556  0.15498045  1
  C  C40  1  0.72945579  0.89960720  0.66065413  1
  C  C41  1  0.10875768  0.27682397  0.84501778  1
  C  C42  1  0.29512911  0.07865946  0.21319364  1
  C  C43  1  0.91133385  0.70015089  0.28153651  1
  C  C44  1  0.70487163  0.92133845  0.78680648  1
  C  C45  1  0.08866482  0.29985043  0.71846360  1
  C  C46  1  0.40655636  0.08971806  0.15576127  1
  C  C47  1  0.90636015  0.58669413  0.34103143  1
  C  C48  1  0.59344516  0.91027796  0.84424012  1
  C  C49  1  0.09363595  0.41330967  0.65896576  1
  N  N50  1  0.16007407  0.07472118  0.36890168  1
  N  N51  1  0.91396842  0.83654060  0.12573289  1
  N  N52  1  0.83992457  0.92527992  0.63109816  1
  N  N53  1  0.08603545  0.16345872  0.87426661  1
  N  N54  1  0.11438272  0.04295886  0.26658411  1
  N  N55  1  0.94579612  0.88141780  0.22769267  1
  N  N56  1  0.88561629  0.95704205  0.73341574  1
  N  N57  1  0.05420302  0.11858325  0.77230868  1
  N  N58  1  0.19566259  0.04277102  0.17172014  1
  N  N59  1  0.93990659  0.80242112  0.32388193  1
  N  N60  1  0.80433684  0.95722855  0.82828054  1
  N  N61  1  0.06009159  0.19758013  0.67611861  1
  O  O62  1  0.92311290  0.11225157  0.06501281  1
  O  O63  1  0.89072440  0.05682104  0.42431235  1
  O  O64  1  0.07688632  0.88774932  0.93498682  1
  O  O65  1  0.10927255  0.94318234  0.57568652  1
  O  O66  1  0.70295815  0.13937771  0.24489290  1
  O  O67  1  0.85587873  0.28883962  0.25762157  1
  O  O68  1  0.29704087  0.86062345  0.75510577  1
  O  O69  1  0.14412150  0.71116203  0.74237914  1
  O  O70  1  0.65245352  0.08093586  0.06071648  1
  O  O71  1  0.91755326  0.33894095  0.43981674  1
  O  O72  1  0.34755036  0.91905781  0.93928104  1
  O  O73  1  0.08244380  0.66106189  0.56018765  1
