# generated using pymatgen
data_Mn2CrCoH28(C7N8)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.11692230
_cell_length_b   10.13712041
_cell_length_c   12.55332813
_cell_angle_alpha   90.04735411
_cell_angle_beta   89.95624376
_cell_angle_gamma   106.45259052
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2CrCoH28(C7N8)4
_chemical_formula_sum   'Mn2 Cr1 Co1 H28 C28 N32'
_cell_volume   990.62186536
_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
  Mn  Mn0  1  0.15634304  0.13205771  0.55131065  1
  Co  Co1  1  0.34272888  0.87198724  0.05988441  1
  Mn  Mn2  1  0.84296507  0.86579608  0.44439530  1
  Cr  Cr3  1  0.64957200  0.12574795  0.94809873  1
  H  H4  1  0.11346835  0.44791727  0.58106074  1
  H  H5  1  0.38631717  0.55053668  0.08212969  1
  H  H6  1  0.88534516  0.55029517  0.41778376  1
  H  H7  1  0.61227307  0.44802412  0.91792253  1
  H  H8  1  0.18614930  0.64836839  0.46101740  1
  H  H9  1  0.31380168  0.35173001  0.96218623  1
  H  H10  1  0.81212281  0.35053196  0.53854170  1
  H  H11  1  0.68525100  0.64667615  0.03774700  1
  H  H12  1  0.38817903  0.65409292  0.30553080  1
  H  H13  1  0.11206112  0.34716404  0.80637683  1
  H  H14  1  0.61185164  0.34646621  0.69431879  1
  H  H15  1  0.88668555  0.65144542  0.19405072  1
  H  H16  1  0.50027562  0.44930514  0.27804748  1
  H  H17  1  1.00250759  0.55363639  0.77874219  1
  H  H18  1  0.50127719  0.55244442  0.72168978  1
  H  H19  1  -0.00073938  0.44719729  0.22028010  1
  H  H20  1  0.52922749  0.23210566  0.34650144  1
  H  H21  1  0.97488967  0.76971290  0.84830615  1
  H  H22  1  0.47282638  0.76900515  0.65242351  1
  H  H23  1  0.02773011  0.22921355  0.15189839  1
  H  H24  1  0.49485258  0.00016048  0.37637295  1
  H  H25  1  1.00749590  1.00016340  0.87853670  1
  H  H26  1  0.50667580  1.00016462  0.62154171  1
  H  H27  1  -0.00647112  -0.00095384  0.12388521  1
  H  H28  1  0.32928135  0.90168788  0.46098038  1
  H  H29  1  0.17072562  0.09926923  0.96459589  1
  H  H30  1  0.67201865  0.09801335  0.53674090  1
  H  H31  1  0.83059597  0.89796604  0.03888587  1
  C  C32  1  0.19242906  0.44756119  0.51074437  1
  C  C33  1  0.30672364  0.55230479  0.01238941  1
  C  C34  1  0.80675753  0.55137001  0.48814987  1
  C  C35  1  0.69231000  0.44615219  0.98754677  1
  C  C36  1  0.23747559  0.56225943  0.44410921  1
  C  C37  1  0.26245431  0.43779627  0.94514403  1
  C  C38  1  0.76152206  0.43708804  0.55526355  1
  C  C39  1  0.73688114  0.56062956  0.05442305  1
  C  C40  1  0.34898350  0.56522180  0.35811945  1
  C  C41  1  0.15160089  0.43583815  0.85915906  1
  C  C42  1  0.65084522  0.43508130  0.64147827  1
  C  C43  1  0.84830972  0.56344478  0.14041945  1
  C  C44  1  0.41296508  0.45378121  0.34298322  1
  C  C45  1  0.08861582  0.54774375  0.84393466  1
  C  C46  1  0.58775508  0.54696314  0.65652593  1
  C  C47  1  0.91249863  0.45213292  0.15519377  1
  C  C48  1  0.35987820  0.34014559  0.41209497  1
  C  C49  1  0.14171553  0.66076194  0.91396319  1
  C  C50  1  0.64092494  0.66000663  0.58685739  1
  C  C51  1  0.85962499  0.33837709  0.08591796  1
  C  C52  1  0.42348362  0.22220757  0.40316472  1
  C  C53  1  0.07971662  0.77991394  0.90526134  1
  C  C54  1  0.57798507  0.77820000  0.59548735  1
  C  C55  1  0.92145501  0.21973395  0.09570828  1
  C  C56  1  0.43365113  -0.00263751  0.45489676  1
  C  C57  1  0.06781651  1.00292272  0.95735120  1
  C  C58  1  0.56774642  1.00232029  0.54303273  1
  C  C59  1  0.93237116  -0.00483746  0.04532719  1
  N  N60  1  0.24423179  0.33403203  0.49300868  1
  N  N61  1  0.25313436  0.66445923  0.99591391  1
  N  N62  1  0.75551574  0.66520816  0.50549191  1
  N  N63  1  0.74551650  0.33309951  0.00408636  1
  N  N64  1  0.35673050  0.11236805  0.45959156  1
  N  N65  1  0.14647591  0.88920049  0.96167857  1
  N  N66  1  0.64469778  0.88723350  0.53813938  1
  N  N67  1  0.85232674  0.10840397  0.04080192  1
  N  N68  1  0.03564847  0.91572388  0.57304254  1
  N  N69  1  0.48697003  0.09021353  0.07331186  1
  N  N70  1  0.96413514  0.08319363  0.42326547  1
  N  N71  1  0.52734809  0.92269891  0.92427010  1
  N  N72  1  0.09647592  0.83257823  0.61500090  1
  N  N73  1  0.41407911  0.16718456  0.11351570  1
  N  N74  1  0.90244858  0.16683402  0.38282803  1
  N  N75  1  0.58610674  0.83466884  0.88766346  1
  N  N76  1  0.15799883  0.75135859  0.65039786  1
  N  N77  1  0.33995125  0.24048188  0.14812857  1
  N  N78  1  0.84142380  0.24921712  0.34901181  1
  N  N79  1  0.65036699  0.75360668  0.85520334  1
  N  N80  1  0.95391112  0.18916392  0.65524690  1
  N  N81  1  0.52989759  0.80734653  0.14630184  1
  N  N82  1  0.03749104  0.80581486  0.34192856  1
  N  N83  1  0.46157524  0.18866934  0.85672869  1
  N  N84  1  0.87313546  0.16057603  0.73446471  1
  N  N85  1  0.61580266  0.84268673  0.22329023  1
  N  N86  1  0.12778718  0.84289126  0.26666431  1
  N  N87  1  0.38036070  0.15587098  0.77703903  1
  N  N88  1  0.79203020  0.14128230  0.81409364  1
  N  N89  1  0.70728918  0.87392869  0.29765680  1
  N  N90  1  0.22240390  0.88212962  0.19498056  1
  N  N91  1  0.29395967  0.12747891  0.70083454  1
