# generated using pymatgen
data_Li4Cr2C4SO16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.41767800
_cell_length_b   9.48450229
_cell_length_c   16.29948792
_cell_angle_alpha   74.48445080
_cell_angle_beta   73.81892466
_cell_angle_gamma   60.57825807
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li4Cr2C4SO16
_chemical_formula_sum   'Li16 Cr8 C16 S4 O64'
_cell_volume   1202.95967921
_cell_formula_units_Z   4
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
  Li  Li0  1  0.78230900  0.28252000  0.03277600  1
  Li  Li1  1  0.41816500  0.91860600  0.16957500  1
  Li  Li2  1  0.99290600  0.91877400  0.16853900  1
  Li  Li3  1  0.41918100  0.49169200  0.16913300  1
  Li  Li4  1  0.67721500  0.63142200  0.45491100  1
  Li  Li5  1  0.13622500  0.18721900  0.45873000  1
  Li  Li6  1  0.08527000  0.58844900  0.34223700  1
  Li  Li7  1  0.91886300  0.40968100  0.67273100  1
  Li  Li8  1  0.89641800  0.77796600  0.53430800  1
  Li  Li9  1  0.69794800  0.21858000  0.45476800  1
  Li  Li10  1  0.93005000  0.99341500  0.67101100  1
  Li  Li11  1  0.63200000  0.70625900  0.95626200  1
  Li  Li12  1  0.20682700  0.13284500  0.95561800  1
  Li  Li13  1  0.48520600  0.43330800  0.66287800  1
  Li  Li14  1  0.59350900  0.09279000  0.84238800  1
  Li  Li15  1  0.20605100  0.70636900  0.95550100  1
  Cr  Cr16  1  0.00076000  0.50029100  0.99979900  1
  Cr  Cr17  1  0.74870500  0.75112300  0.24934000  1
  Cr  Cr18  1  0.25027800  0.24904100  0.25024900  1
  Cr  Cr19  1  0.49952500  0.00078300  0.49960800  1
  Cr  Cr20  1  0.74945000  0.25045400  0.25012600  1
  Cr  Cr21  1  0.75289900  0.74888500  0.75038100  1
  Cr  Cr22  1  0.25091500  0.25042600  0.75013400  1
  Cr  Cr23  1  0.25192800  0.75056500  0.74981300  1
  C  C24  1  0.07430300  0.20711000  0.13841000  1
  C  C25  1  0.70485600  0.57182100  0.14039000  1
  C  C26  1  0.07964900  0.57456900  0.14371900  1
  C  C27  1  0.89056400  0.39697100  0.32717200  1
  C  C28  1  0.42525900  0.92695700  0.35577300  1
  C  C29  1  0.60842900  0.10500000  0.17466000  1
  C  C30  1  0.42689400  0.28909000  0.36028400  1
  C  C31  1  0.79405900  0.92676600  0.35844400  1
  C  C32  1  0.57899600  0.70573600  0.63988500  1
  C  C33  1  0.20610300  0.07465600  0.64044600  1
  C  C34  1  0.58155400  0.07345000  0.64254000  1
  C  C35  1  0.39286500  0.89603900  0.82738200  1
  C  C36  1  0.92394400  0.42788600  0.85669700  1
  C  C37  1  0.10897400  0.60656600  0.67476700  1
  C  C38  1  0.92701300  0.79120500  0.86033700  1
  C  C39  1  0.29295900  0.42919200  0.85806700  1
  S  S40  1  0.31250900  0.81250700  0.06249100  1
  S  S41  1  0.81195000  0.31228500  0.56269300  1
  S  S42  1  0.17792100  0.68725900  0.43784800  1
  S  S43  1  0.68803300  0.18756300  0.93764400  1
  O  O44  1  0.40891000  0.65207700  0.02940900  1
  O  O45  1  0.15112200  0.90724100  0.03049300  1
  O  O46  1  0.40983300  0.90854600  0.03079900  1
  O  O47  1  0.28027100  0.78222700  0.15930400  1
  O  O48  1  0.77457900  0.52079700  0.06541900  1
  O  O49  1  0.93926700  0.19210400  0.14787200  1
  O  O50  1  0.12594600  0.27713900  0.06528300  1
  O  O51  1  0.64061700  0.48995100  0.20143600  1
  O  O52  1  0.69574500  0.70587000  0.15093100  1
  O  O53  1  0.15662300  0.14610000  0.20088400  1
  O  O54  1  0.86923400  0.27281700  0.32701200  1
  O  O55  1  0.02744200  0.62561100  0.07119800  1
  O  O56  1  0.50250700  0.84972700  0.29010300  1
  O  O57  1  0.46491300  0.11767800  0.17739600  1
  O  O58  1  0.76674500  0.54166800  0.32908200  1
  O  O59  1  0.21502800  0.44212000  0.15453600  1
  O  O60  1  0.28999800  0.06234200  0.35059600  1
  O  O61  1  0.73736600  0.96416100  0.17615100  1
  O  O62  1  0.03779600  0.37577100  0.32884600  1
  O  O63  1  0.99747000  0.66212700  0.20650100  1
  O  O64  1  0.90727700  0.15256100  0.52879300  1
  O  O65  1  0.65003700  0.40816400  0.53027300  1
  O  O66  1  0.48684200  0.86913300  0.42636100  1
  O  O67  1  0.62444500  0.23623600  0.17130000  1
  O  O68  1  0.34419100  0.36009900  0.29612400  1
  O  O69  1  0.80575900  0.78798000  0.35074000  1
  O  O70  1  0.90883900  0.40775500  0.53227800  1
  O  O71  1  0.77888100  0.28041900  0.65944700  1
  O  O72  1  0.44449200  0.69347800  0.64967400  1
  O  O73  1  0.27638400  0.02674100  0.56563500  1
  O  O74  1  0.36908300  0.21666300  0.42975500  1
  O  O75  1  0.85045900  0.00806500  0.29348900  1
  O  O76  1  0.63241500  0.77699400  0.56627700  1
  O  O77  1  0.14272000  0.99079100  0.70105500  1
  O  O78  1  0.56624600  0.29014300  0.35283900  1
  O  O79  1  0.72529200  0.98005200  0.43231500  1
  O  O80  1  0.20090100  0.71670300  0.34105300  1
  O  O81  1  0.07068100  0.59593100  0.46720300  1
  O  O82  1  0.19246400  0.21007100  0.65292000  1
  O  O83  1  0.66507700  0.64215800  0.70112300  1
  O  O84  1  0.52902500  0.12666800  0.57017800  1
  O  O85  1  0.37192000  0.77217800  0.82668300  1
  O  O86  1  0.07358900  0.84398800  0.47459500  1
  O  O87  1  0.33622500  0.59137200  0.46894600  1
  O  O88  1  0.96501100  0.62285800  0.66986300  1
  O  O89  1  0.00487400  0.35443700  0.79041300  1
  O  O90  1  0.71924500  0.93932800  0.65120600  1
  O  O91  1  0.26954600  0.04093500  0.82922100  1
  O  O92  1  0.23621300  0.46493200  0.67728200  1
  O  O93  1  0.79073700  0.56446900  0.85111600  1
  O  O94  1  0.54035000  0.87406400  0.82985900  1
  O  O95  1  0.50089700  0.15563900  0.70680100  1
  O  O96  1  0.11946400  0.73542900  0.67809500  1
  O  O97  1  0.97818200  0.36532500  0.93019500  1
  O  O98  1  0.84214400  0.86286200  0.79687400  1
  O  O99  1  0.30670700  0.28774200  0.85183400  1
  O  O100  1  0.87016000  0.71720600  0.92981700  1
  O  O101  1  0.35489700  0.50640300  0.79301400  1
  O  O102  1  0.06526100  0.79414100  0.85230200  1
  O  O103  1  0.21639400  0.48944600  0.92872800  1
  O  O104  1  0.59075000  0.09127800  0.96557600  1
  O  O105  1  0.71716000  0.21498600  0.84073400  1
  O  O106  1  0.84733600  0.09725800  0.97202900  1
  O  O107  1  0.59703000  0.34676300  0.97226900  1
