# generated using pymatgen data_NaC64 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.93741614 _cell_length_b 4.93741638 _cell_length_c 67.30314177 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99976605 _symmetry_Int_Tables_number 1 _chemical_formula_structural NaC64 _chemical_formula_sum 'Na2 C128' _cell_volume 1420.90970122 _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 Na Na0 1 0.33332723 0.66667277 0.25000000 1.0 Na Na1 1 0.66667277 0.33332723 0.75000000 1.0 C C2 1 0.83337081 0.16662919 0.47134961 1.0 C C3 1 0.33335097 0.16665068 0.58575655 1.0 C C4 1 0.33339206 0.16662699 0.47134964 1.0 C C5 1 0.16662919 0.83337081 0.97134961 1.0 C C6 1 0.16655236 0.83344764 0.29819153 1.0 C C7 1 0.50012847 0.00017297 0.29819359 1.0 C C8 1 0.50002204 0.99998094 0.91424264 1.0 C C9 1 -0.00003081 0.00003081 0.70176021 1.0 C C10 1 0.16669362 0.33328278 0.85692613 1.0 C C11 1 0.66662318 0.33337682 0.52865038 1.0 C C12 1 0.16669310 0.83330690 0.64307383 1.0 C C13 1 0.83334932 0.66664903 0.91424345 1.0 C C14 1 0.83345055 0.66677817 0.79819141 1.0 C C15 1 0.33322183 0.16654945 0.70180859 1.0 C C16 1 0.66660794 0.83337301 0.52865036 1.0 C C17 1 0.00017297 0.50012847 0.79819359 1.0 C C18 1 0.33339206 0.16662699 0.02865036 1.0 C C19 1 0.99996558 0.50002339 0.52865290 1.0 C C20 1 0.83334895 0.16665105 0.58575664 1.0 C C21 1 0.66663799 0.33336201 0.20176611 1.0 C C22 1 0.83334895 0.16665105 0.91424336 1.0 C C23 1 0.50003566 0.49996434 0.85692678 1.0 C C24 1 -0.00001628 0.00001628 0.08575737 1.0 C C25 1 0.49997661 0.00003442 0.52865290 1.0 C C26 1 0.00003081 -0.00003081 0.20176021 1.0 C C27 1 0.49998505 0.50001495 0.08575734 1.0 C C28 1 0.49996367 1.00003981 0.35692685 1.0 C C29 1 1.00003981 0.49996367 0.85692685 1.0 C C30 1 1.00003981 0.49996367 0.64307315 1.0 C C31 1 0.50013064 0.49986936 0.29819392 1.0 C C32 1 0.66664806 0.33335194 0.41424337 1.0 C C33 1 0.99982703 0.49987153 0.20180641 1.0 C C34 1 0.49997661 0.00003442 0.97134710 1.0 C C35 1 0.49997708 0.50002292 0.52865279 1.0 C C36 1 0.83330690 0.16669310 0.35692617 1.0 C C37 1 0.49987153 0.99982703 0.70180641 1.0 C C38 1 0.16665068 0.33335097 0.08575655 1.0 C C39 1 0.49987153 0.99982703 0.79819359 1.0 C C40 1 0.50003566 0.49996434 0.64307322 1.0 C C41 1 0.33328278 0.16669362 0.35692613 1.0 C C42 1 0.50002204 0.99998094 0.58575736 1.0 C C43 1 0.66660794 0.83337301 0.97134964 1.0 C C44 1 0.16654945 0.33322183 0.20180859 1.0 C C45 1 0.49986936 0.50013064 0.79819392 1.0 C C46 1 0.50002339 0.99996558 0.47134710 1.0 C C47 1 0.99996558 0.50002339 0.97134710 1.0 C C48 1 0.83337301 0.66660794 0.47134964 1.0 C C49 1 0.66677817 0.83345055 0.29819141 1.0 C C50 1 0.83330638 0.66671722 0.14307387 1.0 C C51 1 0.66664903 0.83334932 0.41424345 1.0 C C52 1 0.00003081 -0.00003081 0.29823979 1.0 C C53 1 0.33322183 0.16654945 0.79819141 1.0 C C54 1 0.83345055 0.66677817 0.70180859 1.0 C C55 1 0.00003442 0.49997661 0.47134710 1.0 C C56 1 0.66663799 0.33336201 0.29823389 1.0 C C57 1 0.16669310 0.83330690 0.85692617 1.0 C C58 1 0.66662318 0.33337682 0.97134962 1.0 C C59 1 0.16669362 0.33328278 0.64307387 1.0 C C60 1 0.50002292 0.49997708 0.02865279 1.0 C C61 1 0.50003633 -0.00003981 0.85692685 1.0 C C62 1 0.00003663 -0.00003663 0.85692727 1.0 C C63 1 0.83334932 0.66664903 0.58575655 1.0 C C64 1 0.16662919 0.83337081 0.52865039 1.0 C C65 1 0.83337301 0.66660794 0.02865036 1.0 C C66 1 -0.00003663 0.00003663 0.35692727 1.0 C C67 1 0.33335097 0.16665068 0.91424345 1.0 C C68 1 0.99998094 0.50002204 0.41424264 1.0 C C69 1 0.16665105 0.83334895 0.08575664 1.0 C C70 1 0.50003633 -0.00003981 0.64307315 1.0 C C71 1 0.49998505 0.50001495 0.41424266 1.0 C C72 1 -0.00003081 0.00003081 0.79823979 1.0 C C73 1 0.00001906 0.49997796 0.58575736 1.0 C C74 1 0.16655236 0.83344764 0.20180847 1.0 C C75 1 0.83344764 0.16655236 0.70180847 1.0 C C76 1 0.33337682 0.66662318 0.47134962 1.0 C C77 1 0.66664903 0.83334932 0.08575655 1.0 C C78 1 0.83344764 0.16655236 0.79819153 1.0 C C79 1 0.16665105 0.83334895 0.41424336 1.0 C C80 1 0.33336201 0.66663799 0.70176611 1.0 C C81 1 -0.00003981 0.50003633 0.14307315 1.0 C C82 1 0.00001906 0.49997796 0.91424264 1.0 C C83 1 0.00001628 -0.00001628 0.91424263 1.0 C C84 1 0.49997796 0.00001906 0.08575736 1.0 C C85 1 0.83330638 0.66671722 0.35692613 1.0 C C86 1 0.16662699 0.33339206 0.97134964 1.0 C C87 1 0.66670040 0.33329960 0.64307459 1.0 C C88 1 0.33328278 0.16669362 0.14307387 1.0 C C89 1 -0.00002470 0.00002470 0.52865279 1.0 C C90 1 0.33329960 0.66670040 0.14307459 1.0 C C91 1 0.49996367 1.00003981 0.14307315 1.0 C C92 1 0.66671722 0.83330638 0.64307387 1.0 C C93 1 0.16654945 0.33322183 0.29819141 1.0 C C94 1 -0.00003981 0.50003633 0.35692685 1.0 C C95 1 0.33335194 0.66664806 0.58575663 1.0 C C96 1 0.49996434 0.50003566 0.35692678 1.0 C C97 1 0.50002339 0.99996558 0.02865290 1.0 C C98 1 0.33335194 0.66664806 0.91424337 1.0 C C99 1 0.83330690 0.16669310 0.14307383 1.0 C C100 1 0.66671722 0.83330638 0.85692613 1.0 C C101 1 0.50013064 0.49986936 0.20180608 1.0 C C102 1 -0.00001628 0.00001628 0.41424263 1.0 C C103 1 0.49997796 0.00001906 0.41424264 1.0 C C104 1 -0.00002470 0.00002470 0.97134721 1.0 C C105 1 0.49997708 0.50002292 0.97134721 1.0 C C106 1 0.49996434 0.50003566 0.14307322 1.0 C C107 1 0.66670040 0.33329960 0.85692541 1.0 C C108 1 0.00003663 -0.00003663 0.64307273 1.0 C C109 1 0.50001495 0.49998505 0.58575734 1.0 C C110 1 0.50001495 0.49998505 0.91424266 1.0 C C111 1 0.99982703 0.49987153 0.29819359 1.0 C C112 1 -0.00003663 0.00003663 0.14307273 1.0 C C113 1 0.33329960 0.66670040 0.35692541 1.0 C C114 1 0.00017297 0.50012847 0.70180641 1.0 C C115 1 0.00001628 -0.00001628 0.58575737 1.0 C C116 1 0.00002470 -0.00002470 0.47134721 1.0 C C117 1 0.33336201 0.66663799 0.79823389 1.0 C C118 1 0.16662699 0.33339206 0.52865036 1.0 C C119 1 0.16665068 0.33335097 0.41424345 1.0 C C120 1 0.99998094 0.50002204 0.08575736 1.0 C C121 1 0.50002292 0.49997708 0.47134721 1.0 C C122 1 0.00003442 0.49997661 0.02865290 1.0 C C123 1 0.83337081 0.16662919 0.02865039 1.0 C C124 1 0.66664806 0.33335194 0.08575663 1.0 C C125 1 0.33337682 0.66662318 0.02865038 1.0 C C126 1 0.49986936 0.50013064 0.70180608 1.0 C C127 1 0.66677817 0.83345055 0.20180859 1.0 C C128 1 0.00002470 -0.00002470 0.02865279 1.0 C C129 1 0.50012847 0.00017297 0.20180641 1.0