# CIF generated by HEAS from Alexandria entry agm009031815 data_agm009031815 _cell_length_a 13.64133 _cell_length_b 7.66383 _cell_length_c 7.56683 _cell_angle_alpha 58.35298 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 673.43796 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 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 Sc1 Sc 0.06639 0.97843 0.98206 1.00000 Sc2 Sc 0.56639 0.02157 0.01794 1.00000 Mo1 Mo 0.21865 0.47834 0.25176 1.00000 Mo2 Mo 0.71865 0.52166 0.74824 1.00000 I1 I 0.46708 0.49675 0.19989 1.00000 I2 I 0.96708 0.50325 0.80011 1.00000 I3 I 0.31420 0.26058 0.76970 1.00000 I4 I 0.81420 0.73942 0.23030 1.00000 I5 I 0.19530 0.83636 0.46241 1.00000 I6 I 0.69530 0.16364 0.53759 1.00000 I7 I 0.97653 0.23885 0.43901 1.00000 I8 I 0.47653 0.76115 0.56099 1.00000 O1 O 0.34753 0.63794 0.16310 1.00000 O2 O 0.84753 0.36206 0.83690 1.00000 O3 O 0.54927 0.71281 0.11397 1.00000 O4 O 0.04927 0.28719 0.88603 1.00000 O5 O 0.46242 0.48313 0.96850 1.00000 O6 O 0.96242 0.51687 0.03150 1.00000 O7 O 0.31403 0.26599 0.52027 1.00000 O8 O 0.81403 0.73401 0.47973 1.00000 O9 O 0.41988 0.09440 0.88948 1.00000 O10 O 0.91988 0.90560 0.11052 1.00000 O11 O 0.21677 0.06891 0.90053 1.00000 O12 O 0.71677 0.93109 0.09947 1.00000 O13 O 0.21860 0.59233 0.47491 1.00000 O14 O 0.71860 0.40767 0.52509 1.00000 O15 O 0.13052 0.73509 0.70343 1.00000 O16 O 0.63052 0.26491 0.29657 1.00000 O17 O 0.08685 0.92638 0.28355 1.00000 O18 O 0.58685 0.07362 0.71645 1.00000 O19 O 0.95218 0.46701 0.44905 1.00000 O20 O 0.45218 0.53299 0.55095 1.00000 O21 O 0.84231 0.16586 0.42355 1.00000 O22 O 0.34231 0.83414 0.57645 1.00000 O23 O 0.99029 0.03588 0.71377 1.00000 O24 O 0.49029 0.96412 0.28623 1.00000 O25 O 0.12547 0.27949 0.43843 1.00000 O26 O 0.62547 0.72051 0.56157 1.00000 O27 O 0.13894 0.68756 0.09539 1.00000 O28 O 0.63894 0.31244 0.90461 1.00000 O29 O 0.24424 0.36240 0.11234 1.00000 O30 O 0.74424 0.63760 0.88766 1.00000