LMucko/crystallography-open-database huggingface dataset:
Synthesis and characterization of the open-framework magnesium aluminophosphate UiO-28
Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.; Journal of Materials Chemistry 11 (2001) 1242–1247; doi:10.1039/b008728i

data_6000465
_publ_section_title
;
 Synthesis and characterization of the open-framework magnesium
 aluminophosphate UiO-28
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              1242
_journal_page_last               1247
_journal_paper_doi               10.1039/b008728i
_journal_volume                  11
_journal_year                    2001
_chemical_formula_sum            'C4 H16 Al3 Mg N3 O17 P4'
_space_group_name_H-M_alt        'P b c m'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   9.2769
_cell_length_b                   14.7980
_cell_length_c                   14.6110
_cell_volume                     2005.79
_cod_database_code               6000465
Synthesis and characterization of the open-framework magnesium aluminophosphate UiO-28
Kongshaug, K. O.; Fjellvag, H.; Lillerud, K. P.; Journal of Materials Chemistry 11 (2001) 1242–1247; doi:10.1039/b008728i

data_6000466
_publ_section_title
;
 Synthesis and characterization of the open-framework magnesium
 aluminophosphate UiO-28
;
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              1242
_journal_page_last               1247
_journal_paper_doi               10.1039/b008728i
_journal_volume                  11
_journal_year                    2001
_chemical_formula_sum            'C4 H14 Al3 Mg N3 O16 P4'
_space_group_name_H-M_alt        'P b c m'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   9.2186
_cell_length_b                   14.8652
_cell_length_c                   14.5811
_cell_volume                     1998.14
_cod_database_code               6000466
Hydrothermal synthesis and crystal structure of Na2In2[PO3(OH)](4).H2O with a new structure type
Mi, J. X.; Huang, Y. X.; Mao, S. Y.; Huang, X. D.; Wei, Z. B.; Huang, Z. L.; Zhao, J. T.; Journal of Solid State Chemistry 157 (2001) 213–219; doi:10.1006/jssc.2000.9077

data_6000467
_publ_section_title
;
 Hydrothermal synthesis and crystal structure of Na2In2[PO3(OH)](4).H2O
 with a new structure type
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              213
_journal_page_last               219
_journal_paper_doi               10.1006/jssc.2000.9077
_journal_volume                  157
_journal_year                    2001
_chemical_formula_sum            'H6 In2 Na2 O17 P4'
_space_group_name_H-M_alt        'P -1'
_cell_angle_alpha                98.710
_cell_angle_beta                 98.953
_cell_angle_gamma                60.228
_cell_length_a                   9.3013
_cell_length_b                   9.4976
_cell_length_c                   9.2685
_cell_volume                     699.42
_cod_database_code               6000467
Hydrothermal synthesis and crystal structure of a novel layered fluorinated gallium phosphate intercalating 1,12-diaminododecane Ga-4(PO4)(4)F-4.N4C24H60 (MIL-35)
Sassoye, C.; Loiseau, T.; Ferey, G.; Journal of Fluorine Chemistry 107 (2001) 187–192; doi:10.1016/S0022-1139(00)00357-2

data_6000468
_publ_section_title
;
 Hydrothermal synthesis and crystal structure of a novel layered
 fluorinated gallium phosphate intercalating 1,12-diaminododecane
 Ga-4(PO4)(4)F-4.N4C24H60 (MIL-35)
;
_journal_name_full               'Journal of Fluorine Chemistry'
_journal_page_first              187
_journal_page_last               192
_journal_paper_doi               10.1016/S0022-1139(00)00357-2
_journal_volume                  107
_journal_year                    2001
_chemical_formula_sum            'C24 H60 F4 Ga4 N4 O16 P4'
_space_group_name_H-M_alt        'P 1'
_cell_angle_alpha                80.670
_cell_angle_beta                 88.780
_cell_angle_gamma                89.860
_cell_length_a                   5.3930
_cell_length_b                   9.8130
_cell_length_c                   19.2850
_cell_volume                     1006.86
_cod_database_code               6000468
Three-dimensional yttrium oxalates possessing large channels
Vaidhyanathan, R.; Natarajan, S.; Rao, C. N. R.; Chemistry of Materials 13 (2001) 185–191; doi:10.1021/cm000419o

data_6000469
_publ_section_title
;
 Three-dimensional yttrium oxalates possessing large channels
;
_journal_name_full               'Chemistry of Materials'
_journal_page_first              185
_journal_page_last               191
_journal_paper_doi               10.1021/cm000419o
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'C7 H6 K8 N O11 Y'
_space_group_name_H-M_alt        'P -1'
_cell_angle_alpha                60.740
_cell_angle_beta                 72.360
_cell_angle_gamma                84.670
_cell_length_a                   8.2290
_cell_length_b                   9.7390
_cell_length_c                   9.7540
_cell_volume                     648.47
_cod_database_code               6000469
Three-dimensional yttrium oxalates possessing large channels
Vaidhyanathan, R.; Natarajan, S.; Rao, C. N. R.; Chemistry of Materials 13 (2001) 185–191; doi:10.1021/cm000419o

data_6000470
_publ_section_title
;
 Three-dimensional yttrium oxalates possessing large channels
;
_journal_name_full               'Chemistry of Materials'
_journal_page_first              185
_journal_page_last               191
_journal_paper_doi               10.1021/cm000419o
_journal_volume                  13
_journal_year                    2001
_chemical_formula_sum            'C9 H12 N2 O8 Y'
_space_group_name_H-M_alt        'C 1 c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 130.640
_cell_angle_gamma                90.000
_cell_length_a                   11.5520
_cell_length_b                   17.1680
_cell_length_c                   8.7190
_cell_volume                     1312.14
_cod_database_code               6000470
Hybrid open-frameworks: structure determinations and ferromagnetism of MIL-41 or (V(IV)O)(2)M(II)(H2O)(4){HO3P-CH2-PO3}(2).2H(2)O (M = Mn, Co, Ni, Zn): four mixed metallomethylendiphosphonates hydrothermally synthesized by using pre-assembled building units
Barthelet, K.; Jouve, C.; Riou, D.; Ferey, G.; Solid State Sciences 2 (2000) 871–876; doi:10.1016/S1293-2558(00)01093-1

data_6000472
_publ_section_title
;
 Hybrid open-frameworks: structure determinations and ferromagnetism of
 MIL-41 or (V(IV)O)(2)M(II)(H2O)(4){HO3P-CH2-PO3}(2).2H(2)O (M = Mn, Co,
 Ni, Zn): four mixed metallomethylendiphosphonates hydrothermally
 synthesized by using pre-assembled building units
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              871
_journal_page_last               876
_journal_paper_doi               10.1016/S1293-2558(00)01093-1
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'C2 H18 Mn O20 P4 V2'
_space_group_name_H-M_alt        'F d d 2'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   22.0237
_cell_length_b                   22.3722
_cell_length_c                   7.2962
_cell_volume                     3594.97
_cod_database_code               6000472
[H3N(CH2)(3)NH3].Be3(HPO4)(4), a three-dimensional framework beryllophosphate containing tetrahedral 10-rings and 12-rings
Harrison, W. T. A.; International Journal of Inorganic Materials 3 (2001) 17–22; doi:10.1016/S1466-6049(00)00101-X

data_6000473
_publ_section_title
;
 [H3N(CH2)(3)NH3].Be3(HPO4)(4), a three-dimensional framework
 beryllophosphate containing tetrahedral 10-rings and 12-rings
;
_journal_name_full
;
 International Journal of Inorganic Materials
;
_journal_page_first              17
_journal_page_last               22
_journal_paper_doi               10.1016/S1466-6049(00)00101-X
_journal_volume                  3
_journal_year                    2001
_chemical_formula_sum            'C3 H16 Be3 N2 O16 P4'
_space_group_name_H-M_alt        'P 1 21/n 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 91.807
_cell_angle_gamma                90.000
_cell_length_a                   7.4219
_cell_length_b                   31.5289
_cell_length_c                   13.6682
_cell_volume                     3196.83
_cod_database_code               6000473
Synthesis, crystal structure and thermal behaviour of fluoroaluminates of the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni), [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O
Adamczyk, B.; Troyanov, S. I.; Schneider, M.; Kemnitz, E.; Zeitschrift Fur Anorganische Und Allgemeine Chemie 626 (2000) 2543–2548; doi:10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3

data_6000474
_publ_section_title
;
 Synthesis, crystal structure and thermal behaviour of fluoroaluminates of
 the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni),
 [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O
;
_journal_name_full
'Zeitschrift Fur Anorganische Und Allgemeine Chemie'
_journal_page_first              2543
_journal_page_last               2548
_journal_paper_doi
10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al F6 H16 N O6 Zn'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 95.210
_cell_angle_gamma                90.000
_cell_length_a                   12.6880
_cell_length_b                   6.5540
_cell_length_c                   12.6970
_cell_volume                     1051.48
_cod_database_code               6000474
Synthesis, crystal structure and thermal behaviour of fluoroaluminates of the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni), [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O
Adamczyk, B.; Troyanov, S. I.; Schneider, M.; Kemnitz, E.; Zeitschrift Fur Anorganische Und Allgemeine Chemie 626 (2000) 2543–2548; doi:10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3

data_6000475
_publ_section_title
;
 Synthesis, crystal structure and thermal behaviour of fluoroaluminates of
 the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni),
 [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O
;
_journal_name_full
'Zeitschrift Fur Anorganische Und Allgemeine Chemie'
_journal_page_first              2543
_journal_page_last               2548
_journal_paper_doi
10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al F6 H16 N Ni O6'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 94.550
_cell_angle_gamma                90.000
_cell_length_a                   12.6850
_cell_length_b                   6.5170
_cell_length_c                   12.6640
_cell_volume                     1043.61
_cod_database_code               6000475
Synthesis, crystal structure and thermal behaviour of fluoroaluminates of the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni), [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O
Adamczyk, B.; Troyanov, S. I.; Schneider, M.; Kemnitz, E.; Zeitschrift Fur Anorganische Und Allgemeine Chemie 626 (2000) 2543–2548; doi:10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3

data_6000476
_publ_section_title
;
 Synthesis, crystal structure and thermal behaviour of fluoroaluminates of
 the composition (NH4)[M(H2O)(6)] (AlF6) (M = Zn, Ni),
 [Zn(H2O)(6)][AlF5(H2O)], and (PyH)(4)[Al2F10].4 H2O
;
_journal_name_full
'Zeitschrift Fur Anorganische Und Allgemeine Chemie'
_journal_page_first              2543
_journal_page_last               2548
_journal_paper_doi
10.1002/1521-3749(200012)626:12<2543::AID-ZAAC2543>3.0.CO;2-3
_journal_volume                  626
_journal_year                    2000
_chemical_formula_sum            'Al F5 H14 O7 Zn'
_space_group_name_H-M_alt        'C 1 2/m 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 100.020
_cell_angle_gamma                90.000
_cell_length_a                   10.7690
_cell_length_b                   13.7470
_cell_length_c                   6.4870
_cell_volume                     945.70
_cod_database_code               6000476
Hydrothermal synthesis, structural approach, magnetic and Mossbauer study of the layered Fe(III) carboxyethylphosphonate [Fe(OH)(H2O)(O3P-(CH2)(2)-CO2H)] or MIL-37
Riou-Cavellec, M.; Sanselme, M.; Greneche, J. M.; Ferey, G.; Solid State Sciences 2 (2000) 717–724; doi:10.1016/S1293-2558(00)01080-3

data_6000477
_publ_section_title
;
 Hydrothermal synthesis, structural approach, magnetic and Mossbauer study
 of the layered Fe(III) carboxyethylphosphonate
 [Fe(OH)(H2O)(O3P-(CH2)(2)-CO2H)] or MIL-37
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              717
_journal_page_last               724
_journal_paper_doi               10.1016/S1293-2558(00)01080-3
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'C3 H8 Fe O7 P'
_space_group_name_H-M_alt        'P b c 21'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   7.4364
_cell_length_b                   9.5646
_cell_length_c                   20.4537
_cell_volume                     1454.79
_cod_database_code               6000477
Hybrid open frameworks - Hydrothermal synthesis and structure determination of MIL-33: a new vanadomethylendiphosphonate intercalating potassium cations
Riou, D.; Serre, C.; Ferey, G.; International Journal of Inorganic Materials 2 (2000) 551–556; doi:10.1016/S1466-6049(00)00056-8

data_6000478
_publ_section_title
;
 Hybrid open frameworks - Hydrothermal synthesis and structure
 determination of MIL-33: a new vanadomethylendiphosphonate intercalating
 potassium cations
;
_journal_name_full
;
 International Journal of Inorganic Materials
;
_journal_page_first              551
_journal_page_last               556
_journal_paper_doi               10.1016/S1466-6049(00)00056-8
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'C2 H12 K2 O30 P4 V5'
_space_group_name_H-M_alt        'C 1 2/m 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 94.060
_cell_angle_gamma                90.000
_cell_length_a                   4.8716
_cell_length_b                   14.6140
_cell_length_c                   15.8250
_cell_volume                     1123.81
_cod_database_code               6000478
Structural, magnetic, and ion-exchange properties of a new layered alkaline/alkaline earth iron phosphate: NaBaFe4(HPO4)(3)(PO4)(3).H2O
Korzenski, M. B.; Kolis, J. W.; Inorganic Chemistry 39 (2000) 5663–5668; doi:10.1021/ic0001513

data_6000479
_publ_section_title
;
 Structural, magnetic, and ion-exchange properties of a new layered
 alkaline/alkaline earth iron phosphate: NaBaFe4(HPO4)(3)(PO4)(3).H2O
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              5663
_journal_page_last               5668
_journal_paper_doi               10.1021/ic0001513
_journal_volume                  39
_journal_year                    2000
_chemical_formula_sum            'Ba Fe4 H5 Na O25 P6'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 91.820
_cell_angle_gamma                90.000
_cell_length_a                   9.2870
_cell_length_b                   22.6650
_cell_length_c                   8.9660
_cell_volume                     1886.30
_cod_database_code               6000479
An ionic nickel(II) phosphate with ethylenediamine: (C2H10N2)[Ni(H2O)(6)](HPO4)(2). Hydrothermal synthesis, crystal structure, and spectroscopic properties
Escobal, J.; Pizarro, J. L.; Mesa, J. L.; Arriortua, M. I.; Rojo, T.; Journal of Solid State Chemistry 154 (2000) 460–465; doi:10.1006/jssc.2000.8865

data_6000480
_publ_section_title
;
 An ionic nickel(II) phosphate with ethylenediamine:
 (C2H10N2)[Ni(H2O)(6)](HPO4)(2). Hydrothermal synthesis, crystal
 structure, and spectroscopic properties
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              460
_journal_page_last               465
_journal_paper_doi               10.1006/jssc.2000.8865
_journal_volume                  154
_journal_year                    2000
_chemical_formula_sum            'C2 H24 N2 Ni6 O14 P2'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 91.280
_cell_angle_gamma                90.000
_cell_length_a                   6.2260
_cell_length_b                   16.2410
_cell_length_c                   14.7780
_cell_volume                     1493.93
_cod_database_code               6000480
A three-dimensional iron(III) phosphate, [C2N2H10](2)[Fe5F4(PO4)(HPO4)(6)]
Choudhury, A.; Natarajan, S.; Journal of Solid State Chemistry 154 (2000) 507–513; doi:10.1006/jssc.2000.8871

data_6000481
_publ_section_title
;
 A three-dimensional iron(III) phosphate,
 [C2N2H10](2)[Fe5F4(PO4)(HPO4)(6)]
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              507
_journal_page_last               513
_journal_paper_doi               10.1006/jssc.2000.8871
_journal_volume                  154
_journal_year                    2000
_chemical_formula_sum            'C4 H8 F4 Fe5 N4 O29 P7'
_space_group_name_H-M_alt        'P 43 21 2'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   9.8640
_cell_length_b                   9.8640
_cell_length_c                   30.3530
_cell_volume                     2953.30
_cod_database_code               6000481
Hydrothermal synthesis and characterization of two mixed valence piperazine-vanadium phosphates: (C4H12N2)(H3O)[(VOPO4)(4)(H2O)H2PO4].3H(2)O and (C4H12N2)[(VO)(VO2)(2)(H2O)(PO4)(2)]
Do, J.; Bontchev, R. P.; Jacobson, A. J.; Journal of Solid State Chemistry 154 (2000) 514–523; doi:10.1006/jssc.2000.8872

data_6000482
_publ_section_title
;
 Hydrothermal synthesis and characterization of two mixed valence
 piperazine-vanadium phosphates:
 (C4H12N2)(H3O)[(VOPO4)(4)(H2O)H2PO4].3H(2)O and
 (C4H12N2)[(VO)(VO2)(2)(H2O)(PO4)(2)]
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              514
_journal_page_last               523
_journal_paper_doi               10.1006/jssc.2000.8872
_journal_volume                  154
_journal_year                    2000
_chemical_formula_sum            'C4 H25 N2 O29 P5 V4'
_space_group_name_H-M_alt        'P 1 2/n 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 91.936
_cell_angle_gamma                90.000
_cell_length_a                   9.6448
_cell_length_b                   8.8770
_cell_length_c                   14.8130
_cell_volume                     1267.52
_cod_database_code               6000482
Hydrothermal synthesis and characterization of two mixed valence piperazine-vanadium phosphates: (C4H12N2)(H3O)[(VOPO4)(4)(H2O)H2PO4].3H(2)O and (C4H12N2)[(VO)(VO2)(2)(H2O)(PO4)(2)]
Do, J.; Bontchev, R. P.; Jacobson, A. J.; Journal of Solid State Chemistry 154 (2000) 514–523; doi:10.1006/jssc.2000.8872

data_6000483
_publ_section_title
;
 Hydrothermal synthesis and characterization of two mixed valence
 piperazine-vanadium phosphates:
 (C4H12N2)(H3O)[(VOPO4)(4)(H2O)H2PO4].3H(2)O and
 (C4H12N2)[(VO)(VO2)(2)(H2O)(PO4)(2)]
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              514
_journal_page_last               523
_journal_paper_doi               10.1006/jssc.2000.8872
_journal_volume                  154
_journal_year                    2000
_chemical_formula_sum            'C4 H14 N2 O14 P2 V3'
_space_group_name_H-M_alt        'P -1'
_cell_angle_alpha                66.598
_cell_angle_beta                 76.008
_cell_angle_gamma                83.439
_cell_length_a                   6.1650
_cell_length_b                   10.8206
_cell_length_c                   11.8540
_cell_volume                     704.04
_cod_database_code               6000483
Layered cobalt phosphates by the amine phosphate route
Choudhury, A.; Natarajan, S.; Rao, C. N. R.; Journal of Solid State Chemistry 155 (2000) 62–70; doi:10.1006/jssc.2000.8892

data_6000484
_publ_section_title
;
 Layered cobalt phosphates by the amine phosphate route
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              62
_journal_page_last               70
_journal_paper_doi               10.1006/jssc.2000.8892
_journal_volume                  155
_journal_year                    2000
_chemical_formula_sum            'C3 H12 Co2 N2 O9 P2'
_space_group_name_H-M_alt        'P b c n'
_cell_angle_alpha                90.000
_cell_angle_beta                 90.000
_cell_angle_gamma                90.000
_cell_length_a                   22.8940
_cell_length_b                   7.5680
_cell_length_c                   6.6970
_cell_volume                     1160.33
_cod_database_code               6000484
Layered cobalt phosphates by the amine phosphate route
Choudhury, A.; Natarajan, S.; Rao, C. N. R.; Journal of Solid State Chemistry 155 (2000) 62–70; doi:10.1006/jssc.2000.8892

data_6000485
_publ_section_title
;
 Layered cobalt phosphates by the amine phosphate route
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              62
_journal_page_last               70
_journal_paper_doi               10.1006/jssc.2000.8892
_journal_volume                  155
_journal_year                    2000
_chemical_formula_sum            'C3 H15 Co2 N2 O13 P3'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90.000
_cell_angle_beta                 93.230
_cell_angle_gamma                90.000
_cell_length_a                   8.6080
_cell_length_b                   9.6400
_cell_length_c                   17.2580
_cell_volume                     1429.81
_cod_database_code               6000485
Synthesis and characterization of a novel layered zinc phosphate
Kongshaug, Kjell Ove; Fjellvag, Helmer; Lillerud, Karl Petter; Solid State Sciences 2 (2000) 569–576; doi:10.1016/S1293-2558(00)01064-5

data_6000486
_publ_section_title
;
 Synthesis and characterization of a novel layered zinc phosphate
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              569
_journal_page_last               576
_journal_paper_doi               10.1016/S1293-2558(00)01064-5
_journal_volume                  2
_journal_year                    2000
_chemical_formula_sum            'C6 H20 N3 O13 P3 Zn3'
_chemical_formula_weight         631.30
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2ybc'
_space_group_name_H-M_alt        'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 109.1346(7)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   12.6707(2)
_cell_length_b                   8.24293(8)
_cell_length_c                   18.4843(2)
_cell_volume                     1823.91(4)
_diffrn_ambient_temperature      293
_diffrn_radiation_probe          x-ray
_diffrn_radiation_type           synchrotron
_diffrn_radiation_wavelength     0.52227
_pd_proc_ls_prof_wR_factor       0.1208
_refine_ls_number_parameters     178
_refine_ls_number_reflns         1555
_refine_ls_R_I_factor            0.0844
_cod_depositor_comments
;
Powder diffraction
software : EXTRA, EXPO, SIRPOW92
Rietveld refinement using GSAS
;
_cod_database_code               6000486