#------------------------------------------------------------------------------
#$Date: 2008-01-26 17:25:03 +0000 (Sat, 26 Jan 2008) $
#$Revision: 20 $
#$URL: svn://www.crystallography.net/cod/cif/2/2003700.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_2003700
_journal_name_full   'Acta Crystallographica'
_journal_year        1995
_journal_volume    	C51
_journal_page_first    	1258
_journal_page_last    	1260
_publ_section_title
;
Sodium Bis(2,3-dimethylbutan-2,3-diolato)
hydroxogermanate(IV) Methanol (1/3)
;
_chemical_formula_moiety    	'C15 H37 Ge1 Na1 O8'
_chemical_formula_sum    	'C15 H37 Ge1 Na1 O8'
_chemical_formula_weight    	441.03
loop_
    _symmetry_equiv_pos_as_xyz
    'x,y,z'
    '-x,-y,-z'
_symmetry_space_group_name_H-M    	'P -1'
_cell_length_a    	10.235(5)
_cell_length_b    	10.249(8)
_cell_length_c    	11.810(3)
_cell_angle_alpha    	86.88(4)
_cell_angle_beta    	80.46(3)
_cell_angle_gamma    	66.59(6)
_cell_volume    	1121(1)
_cell_formula_units_Z    	2
_exptl_crystal_density_diffrn    	1.307
_exptl_crystal_density_meas    	1.3
_exptl_crystal_density_method    	'flotation in CH~2~Cl~2~/C~2~H~5~OH'
_diffrn_radiation_type    	'MoK\a'
_diffrn_radiation_wavelength    	0.71073
_cell_measurement_reflns_used    	25
_cell_measurement_theta_min    	10.12
_cell_measurement_theta_max    	13.11
_exptl_absorpt_coefficient_mu    	1.40
_cell_measurement_temperature    	218
_exptl_crystal_description    	'plate'
_exptl_crystal_size_max    	0.50
_exptl_crystal_size_mid    	0.45
_exptl_crystal_size_min    	0.20
_exptl_crystal_size_rad    	?
_exptl_crystal_colour    	'colourless'
_chemical_compound_source    	'evaporation from water'
_diffrn_measurement_device    	'Enraf-Nonius CAD4'
_diffrn_measurement_method    	'\w/2\q'
_exptl_absorpt_correction_type    	'empirical'
_exptl_absorpt_correction_T_min    	0.949
_exptl_absorpt_correction_T_max    	1.000
_diffrn_reflns_number    	2927
_reflns_number_total    	2917
_reflns_number_observed    	2646
_reflns_observed_criterion    	>2\s(I)
_diffrn_reflns_av_R_equivalents    	?
_diffrn_reflns_theta_max    	22.5
_diffrn_reflns_limit_h_min    	-9
_diffrn_reflns_limit_h_max    	11
_diffrn_reflns_limit_k_min    	0
_diffrn_reflns_limit_k_max    	11
_diffrn_reflns_limit_l_min    	-12
_diffrn_reflns_limit_l_max    	12
_diffrn_standards_number    	3
_diffrn_standards_interval_count    	?
_diffrn_standards_interval_time    	120
_diffrn_standards_decay_%    	+-3
_refine_ls_structure_factor_coef    	F
_refine_ls_R_factor_obs    	0.032
_refine_ls_wR_factor_obs    	0.039
_refine_ls_goodness_of_fit_obs    	2.59
_refine_ls_number_reflns    	2646
_refine_ls_number_parameters    	227
_refine_ls_hydrogen_treatment    	'H-atom positions taken from \DF map and not r
_refine_ls_weighting_scheme    	'1/[\s^2^(F)+0.0001F^2^]'
_refine_ls_shift/esd_max    	0.012
_refine_diff_density_max    	0.60
_refine_diff_density_min    	-0.33
_refine_ls_extinction_method    	'secondary extinction (NRCVAX; Larsen et al., 1
_refine_ls_extinction_coef    	2.1(5)\mm
_atom_type_scat_source    	'IntTabIV'
loop_
    _atom_site_label
    _atom_site_fract_x
    _atom_site_fract_y
    _atom_site_fract_z
    _atom_site_b_iso_or_equiv
    Ge .93310(4) .17596(4) .16909(3) 2.47(2)
    O(1) 1.0425(2) -.0187(2) .1446(2) 3.0(1)
    O(2) 1.0806(2) .1841(2) .2298(2) 3.4(1)
    O(3) .7906(2) .1338(2) .2503(2) 3.3(1)
    O(4) .8222(2) .3657(2) .2114(2) 3.3(1)
    O(5) .9318(2) .2198(2) .0222(2) 3.2(1)
    C(1) 1.1884(4) -.0536(4) .1590(4) 4.9(2)
    C(2) 1.1847(4) .0467(4) .2508(4) 4.8(2)
    C(3) 1.2711(4) -.0181(5) .0434(4) 5.6(2)
    C(4) 1.2589(4) -.2089(4) .1796(4) 5.4(2)
    C(5) 1.1261(5) -.0034(6) .3703(4) 7.2(3)
    C(6) 1.3230(5) .0580(5) .2614(5) 6.4(3)
    C(7) .6618(4) .2563(4) .2875(3) 3.6(2)
    C(8) .7126(4) .3773(4) .3074(3) 3.8(2)
    C(9) .5828(4) .2176(5) .3954(4) 5.2(2)
    C(10) .5695(4) .2931(5) .1926(4) 5.1(2)
    C(11) .7785(4) .3567(5) .4166(3) 5.0(2)
    C(12) .5937(5) .5237(4) .3081(4) 5.8(2)
    C(13) 1.2131(8) .1819(6) -.3229(7) 11.7(5)
    C(14) 1.3053(5) .3645(6) -.0178(5) 7.9(3)
    C(15) .8698(5) .5367(5) -.3414(4) 6.2(3)
    O(6) 1.1147(4) .1913(3) -.2319(3) 7.3(2)
    O(7) 1.1706(3) .4473(3) -.0507(2) 4.3(1)
    O(8) .9112(4) .5491(3) -.2403(3) 6.7(2)
    Na .9929(2) .3781(2) -.0998(1) 4.60(9)
    HO(5) .951 .161 -.014 3.8
    HO(6) 1.026 .226 -.257 8.2
    HO(7) 1.184 .501 -.113 5.1
    HO(8) 1.011 .495 -.266 8.4
    H(3A) 1.232 .096 .037 6.2
    H(3B) 1.245 -.061 -.027 6.2
    H(3C) 1.383 -.067 .052 6.2
    H(4A) 1.256 -.266 .118 5.8
    H(4B) 1.358 -.238 .188 5.8
    H(4C) 1.212 -.236 .250 5.8
    H(5A) 1.029 -.016 .362 7.8
    H(5B) 1.102 .079 .433 7.8
    H(5C) 1.212 -.101 .387 7.8
    H(6A) 1.313 .123 .319 6.2
    H(6B) 1.395 -.033 .275 6.2
    H(6C) 1.363 .090 .188 6.2
    H(9A) .494 .296 .423 5.8
    H(9B) .562 .137 .383 5.8
    H(9C) .641 .195 .457 5.8
    H(10A) .546 .214 .177 5.8
    H(10B) .478 .372 .216 5.8
    H(10C) .615 .318 .124 5.8
    H(11A) .818 .424 .423 5.6
    H(11B) .708 .363 .483 5.6
    H(11C) .854 .262 .416 5.6
    H(12A) .517 .535 .370 6.0
    H(12B) .628 .596 .311 6.0
    H(12C) .551 .536 .237 6.0
    H(13A) 1.210 .123 -.386 11.3
    H(13B) 1.312 .133 -.306 11.3
    H(13C) 1.198 .288 -.356 11.3
    H(14A) 1.296 .304 .046 7.7
    H(14B) 1.372 .304 -.079 7.7
    H(14C) 1.347 .440 .008 7.7
    H(15A) .887 .604 -.399 7.4
    H(15B) .768 .558 -.333 7.4
    H(15C) .932 .430 -.373 7.4