data_Crystal
_audit_creation_method         'generated by CrystalMaker X for Windows'
_cell_length_a                  33.020000
_cell_length_b                  33.020000
_cell_length_c                  22.796000
_cell_angle_alpha               90.000000
_cell_angle_beta                90.000000
_cell_angle_gamma              120.000000

_symmetry_space_group_name_H-M     'P 1'

loop_
_symmetry_equiv_pos_as_xyz
'+x,+y,+z'

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
 Site1  C 0.11910   0.55960   0.57130  1.0
 Site2	C 0.44040   0.55950   0.57130   1.000
 Site3  C 0.44050   0.88090   0.57130   1.000
 C4  	C 0.07117   0.21573   0.93523   1.000
 C5		C 0.14457   0.21573   0.93523   1.000
 Site6	C 0.44040   0.88090   0.57130   1.000
 Site7  C 0.44050   0.55960   0.57130   1.000
 Site8  C 0.11910   0.55950   0.57130   1.000