_symmetry_cell_setting                 triclinic
_symmetry_space_group_name_H-M        'P -1bar'

_cell_length_a                         8.005(2)
_cell_length_b                         12.947(3)
_cell_length_c                         13.814(4)
_cell_angle_alpha                      73.162(11)
_cell_angle_beta                       75.546(11)
_cell_angle_gamma                      73.341(11)
_cell_volume                           1291.0(6)
_cell_formula_units_Z                  4

_diffrn_radiation_type                'Mo K\a'
_diffrn_radiation_wavelength           0.71070
_diffrn_measurement_device_type       'Rigaku Mercury'
 _diffrn_ambient_temperature           298

_refine_ls_number_reflns               4287
_refine_ls_number_parameters           309
_refine_ls_goodness_of_fit_ref         1.038

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
_atom_site_adp_type
_atom_site_occupancy
_atom_site_symmetry_multiplicity
_atom_site_calc_flag
_atom_site_refinement_flags
_atom_site_disorder_assembly
_atom_site_disorder_group
 Co(1) Co 0.65057(8) 0.08196(5) 0.18258(4) 0.03612(15) Uani 1.00 1 d . . .
 Co(2) Co 0.74366(7) 0.54543(5) 0.17421(5) 0.03605(15) Uani 1.00 1 d . . .
 I(1) I 0.39255(4) -0.02307(3) 0.22254(3) 0.05281(10) Uani 1.00 1 d . . .
 I(2) I 0.99067(4) 0.63538(3) 0.18899(3) 0.05038(10) Uani 1.00 1 d . . .
 S(1) S 0.65683(17) 0.06380(10) 0.34455(10) 0.0463(3) Uani 1.00 1 d . . .
 S(2) S 0.46561(17) 0.24271(9) 0.18417(9) 0.0452(3) Uani 1.00 1 d . . .
 S(3) S 0.91140(17) 0.37688(10) 0.19059(9) 0.0464(3) Uani 1.00 1 d . . .
 S(4) S 0.64891(16) 0.50493(10) 0.34017(9) 0.0453(3) Uani 1.00 1 d . . .
 C(1) C 0.5080(5) 0.1763(3) 0.3825(3) 0.0381(11) Uani 1.00 1 d . . .
 C(2) C 0.4210(5) 0.2599(3) 0.3065(3) 0.0344(10) Uani 1.00 1 d . . .
 C(3) C 0.2980(6) 0.3573(3) 0.3231(3) 0.0445(12) Uani 1.00 1 d . . .
 C(4) C 0.2228(6) 0.3946(4) 0.4110(4) 0.0506(14) Uani 1.00 1 d . . .
 C(5) C 0.2524(7) 0.3464(5) 0.5098(4) 0.0621(17) Uani 1.00 1 d . . .
 C(6) C 0.3697(8) 0.2484(5) 0.5433(4) 0.0635(17) Uani 1.00 1 d . . .
 C(7) C 0.4844(6) 0.1762(4) 0.4854(3) 0.0498(14) Uani 1.00 1 d . . .
 C(8) C 0.7850(10) 0.1446(6) 0.0396(5) 0.087(2) Uani 1.00 1 d . . .
 C(9) C 0.7397(8) 0.0550(8) 0.0363(5) 0.083(2) Uani 1.00 1 d . . .
 C(10) C 0.8158(9) -0.0330(5) 0.1046(6) 0.083(2) Uani 1.00 1 d . . .
 C(11) C 0.9123(7) 0.0035(7) 0.1529(5) 0.091(2) Uani 1.00 1 d . . .
 C(12) C 0.8888(9) 0.1174(7) 0.1123(6) 0.089(2) Uani 1.00 1 d . . .
 C(13) C 0.8954(5) 0.3183(3) 0.3189(3) 0.0380(11) Uani 1.00 1 d . . .
 C(14) C 0.7772(5) 0.3788(3) 0.3894(3) 0.0394(11) Uani 1.00 1 d . . .
 C(15) C 0.7542(7) 0.3462(4) 0.4979(3) 0.0554(15) Uani 1.00 1 d . . .
 C(16) C 0.8356(8) 0.2521(5) 0.5611(4) 0.0725(19) Uani 1.00 1 d . . .
 C(17) C 0.9622(9) 0.1629(5) 0.5369(4) 0.0720(19) Uani 1.00 1 d . . .
 C(18) C 1.0346(7) 0.1445(4) 0.4404(4) 0.0614(16) Uani 1.00 1 d . . .
 C(19) C 1.0045(6) 0.2114(3) 0.3458(4) 0.0495(13) Uani 1.00 1 d . . .
 C(20) C 0.7112(8) 0.5571(5) 0.0273(4) 0.0649(18) Uani 1.00 1 d . . .
 C(21) C 0.7226(8) 0.6586(5) 0.0331(4) 0.0649(18) Uani 1.00 1 d . . .
 C(22) C 0.5873(9) 0.6931(5) 0.1091(5) 0.071(2) Uani 1.00 1 d . . .
 C(23) C 0.4883(7) 0.6138(6) 0.1502(5) 0.075(2) Uani 1.00 1 d . . .
 C(24) C 0.5669(9) 0.5270(5) 0.1010(5) 0.073(2) Uani 1.00 1 d . . .
 H(1) H 0.2610 0.4063 0.2624 0.053 Uiso 1.00 1 c R . .
 H(2) H 0.1370 0.4631 0.4028 0.062 Uiso 1.00 1 c R . .
 H(3) H 0.1849 0.3841 0.5617 0.078 Uiso 1.00 1 c R . .
 H(4) H 0.3740 0.2271 0.6146 0.078 Uiso 1.00 1 c R . .
 H(5) H 0.5614 0.1161 0.5228 0.062 Uiso 1.00 1 c R . .
 H(6) H 0.7482 0.2168 -0.0017 0.085 Uiso 1.00 1 c R . .
 H(7) H 0.6645 0.0524 -0.0060 0.103 Uiso 1.00 1 c R . .
 H(8) H 0.8051 -0.1071 0.1169 0.095 Uiso 1.00 1 c R . .
 H(9) H 0.9818 -0.0409 0.2033 0.091 Uiso 1.00 1 c R . .
 H(10) H 0.9415 0.1655 0.1290 0.115 Uiso 1.00 1 c R . .
 H(11) H 0.6693 0.3989 0.5314 0.063 Uiso 1.00 1 c R . .
 H(12) H 0.7994 0.2500 0.6324 0.081 Uiso 1.00 1 c R . .
 H(13) H 1.0008 0.1062 0.5934 0.081 Uiso 1.00 1 c R . .
 H(14) H 1.1202 0.0765 0.4392 0.070 Uiso 1.00 1 c R . .
 H(15) H 1.0669 0.1809 0.2886 0.059 Uiso 1.00 1 c R . .
 H(16) H 0.7885 0.5150 -0.0191 0.078 Uiso 1.00 1 c R . .
 H(17) H 0.8106 0.6975 -0.0068 0.076 Uiso 1.00 1 c R . .
 H(18) H 0.5653 0.7610 0.1288 0.087 Uiso 1.00 1 c R . .
 H(19) H 0.3860 0.6180 0.2028 0.087 Uiso 1.00 1 c R . .
 H(20) H 0.5252 0.4619 0.1127 0.095 Uiso 1.00 1 c R . .

loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
 Co(1) 0.0326(3) 0.0340(2) 0.0400(3) -0.0036(2) -0.0056(2) -0.0109(2)
 Co(2) 0.0311(3) 0.0366(3) 0.0398(3) -0.0047(2) -0.0071(2) -0.0106(2)
 I(1) 0.04195(19) 0.0589(2) 0.0640(2) -0.01664(15) -0.00319(15) -0.02475(17)
 I(2) 0.03927(18) 0.04630(19) 0.0664(2) -0.01317(14) -0.01409(15) -0.00747(15)
 S(1) 0.0517(6) 0.0373(5) 0.0476(6) 0.0010(5) -0.0211(5) -0.0073(4)
 S(2) 0.0553(7) 0.0363(5) 0.0373(5) 0.0047(5) -0.0145(5) -0.0083(4)
 S(3) 0.0526(7) 0.0393(5) 0.0409(6) -0.0015(5) -0.0011(5) -0.0151(4)
 S(4) 0.0383(6) 0.0466(6) 0.0439(6) -0.0019(5) 0.0016(4) -0.0153(5)
 C(1) 0.039(2) 0.036(2) 0.043(2) -0.0143(18) -0.0123(18) -0.0062(17)
 C(2) 0.035(2) 0.034(2) 0.037(2) -0.0106(17) -0.0060(17) -0.0088(17)
 C(3) 0.040(2) 0.037(2) 0.055(2) -0.0057(19) -0.007(2) -0.013(2)
 C(4) 0.044(2) 0.049(2) 0.063(3) -0.007(2) -0.004(2) -0.027(2)
 C(5) 0.062(3) 0.075(3) 0.058(3) -0.013(3) -0.004(2) -0.037(2)
 C(6) 0.070(3) 0.084(4) 0.042(2) -0.022(3) -0.005(2) -0.023(2)
 C(7) 0.053(2) 0.057(2) 0.043(2) -0.015(2) -0.014(2) -0.012(2)
 C(8) 0.080(4) 0.072(4) 0.061(3) 0.005(3) 0.025(3) 0.000(3)
 C(9) 0.057(3) 0.136(6) 0.064(3) -0.014(4) 0.003(3) -0.055(4)
 C(10) 0.068(4) 0.059(3) 0.111(5) -0.016(3) 0.037(3) -0.048(3)
 C(11) 0.033(3) 0.136(6) 0.058(3) 0.027(3) -0.002(2) -0.002(4)
 C(12) 0.057(3) 0.126(6) 0.104(5) -0.053(4) 0.032(3) -0.066(5)
 C(13) 0.032(2) 0.037(2) 0.047(2) -0.0130(17) -0.0029(17) -0.0095(18)
 C(14) 0.031(2) 0.038(2) 0.049(2) -0.0125(18) -0.0007(18) -0.0116(19)
 C(15) 0.048(2) 0.061(3) 0.049(2) -0.015(2) 0.004(2) -0.010(2)
 C(16) 0.073(4) 0.082(4) 0.048(3) -0.023(3) -0.005(2) 0.008(3)
 C(17) 0.075(4) 0.060(3) 0.068(4) -0.016(3) -0.025(3) 0.016(3)
 C(18) 0.058(3) 0.046(2) 0.072(3) -0.014(2) -0.014(2) 0.004(2)
 C(19) 0.045(2) 0.036(2) 0.066(3) -0.007(2) -0.008(2) -0.013(2)
 C(20) 0.077(4) 0.076(3) 0.043(2) -0.000(3) -0.023(2) -0.022(2)
 C(21) 0.062(3) 0.072(3) 0.056(3) -0.017(3) -0.026(2) 0.007(2)
 C(22) 0.073(4) 0.054(3) 0.090(4) 0.012(3) -0.051(3) -0.019(3)
 C(23) 0.035(2) 0.112(5) 0.071(3) 0.001(3) -0.025(2) -0.014(3)
 C(24) 0.085(4) 0.073(3) 0.080(4) -0.030(3) -0.045(3) -0.007(3)