Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 9017857 | CIF | Fe0.752 H2 Mg0.248 O5 S | C 1 2/c 1 | 7.0417; 7.579; 7.753 90; 118.491; 90 | 363.659 | Talla, D.; Wildner, M. Investigation of the kieserite-szomolnokite solid-solution series, (Mg,Fe)SO4*H2O, with relevance to Mars: Crystal chemistry, FTIR, and Raman spectroscopy under ambient and martian temperature conditions Note: Sample Mg0.25Fe0.75 American Mineralogist, 2019, 104, 1732-1749 |
| 9017858 | CIF | Fe H2 O5 S | C 1 2/c 1 | 7.0862; 7.5545; 7.7801 90; 118.612; 90 | 365.629 | Talla, D.; Wildner, M. Investigation of the kieserite-szomolnokite solid-solution series, (Mg,Fe)SO4*H2O, with relevance to Mars: Crystal chemistry, FTIR, and Raman spectroscopy under ambient and martian temperature conditions Note: Sample Mg0.00Fe1.00 American Mineralogist, 2019, 104, 1732-1749 |
| 9017859 | CIF | H2 Mg O5 S | C 1 2/c 1 | 6.8815; 7.6534; 7.6172 90; 117.884; 90 | 354.596 | Talla, D.; Wildner, M. Investigation of the kieserite-szomolnokite solid-solution series, (Mg,Fe)SO4*H2O, with relevance to Mars: Crystal chemistry, FTIR, and Raman spectroscopy under ambient and martian temperature conditions Note: T = -80 C American Mineralogist, 2019, 104, 1732-1749 |
| 9017860 | CIF | H2 Mg O5 S | C 1 2/c 1 | 6.8648; 7.6684; 7.6055 90; 117.792; 90 | 354.185 | Talla, D.; Wildner, M. Investigation of the kieserite-szomolnokite solid-solution series, (Mg,Fe)SO4*H2O, with relevance to Mars: Crystal chemistry, FTIR, and Raman spectroscopy under ambient and martian temperature conditions Note: T = -160 C American Mineralogist, 2019, 104, 1732-1749 |
| 9017861 | CIF | Fe H2 O5 S | C 1 2/c 1 | 7.058; 7.5663; 7.7576 90; 118.454; 90 | 364.234 | Talla, D.; Wildner, M. Investigation of the kieserite-szomolnokite solid-solution series, (Mg,Fe)SO4*H2O, with relevance to Mars: Crystal chemistry, FTIR, and Raman spectroscopy under ambient and martian temperature conditions Note: T = -80 C American Mineralogist, 2019, 104, 1732-1749 |
| 9017862 | CIF | Fe H2 O5 S | C 1 2/c 1 | 7.0404; 7.5756; 7.745 90; 118.368; 90 | 363.476 | Talla, D.; Wildner, M. Investigation of the kieserite-szomolnokite solid-solution series, (Mg,Fe)SO4*H2O, with relevance to Mars: Crystal chemistry, FTIR, and Raman spectroscopy under ambient and martian temperature conditions Note: T = -160 C American Mineralogist, 2019, 104, 1732-1749 |
| 9017863 | CIF | H2 Mg O5 S | C 1 2/c 1 | 6.9103; 7.634; 7.643 90; 118.002; 90 | 355.992 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars American Mineralogist, 2020, 105, 1472-1489 |
| 9017864 | CIF | H2 Mg0.764 Ni0.236 O5 S | C 1 2/c 1 | 6.8909; 7.6222; 7.592 90; 117.984; 90 | 352.137 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars American Mineralogist, 2020, 105, 1472-1489 |
| 9017865 | CIF | H2 Mg0.475 Ni0.525 O5 S | C 1 2/c 1 | 6.8586; 7.6202; 7.5448 90; 117.842; 90 | 348.674 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars American Mineralogist, 2020, 105, 1472-1489 |
| 9017866 | CIF | H2 Mg0.241 Ni0.759 O5 S | C 1 2/c 1 | 6.8446; 7.6144; 7.5018 90; 117.804; 90 | 345.837 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars American Mineralogist, 2020, 105, 1472-1489 |
| 9017867 | CIF | H2 Ni O5 S | C 1 2/c 1 | 6.829; 7.6047; 7.4626 90; 117.749; 90 | 342.981 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars American Mineralogist, 2020, 105, 1472-1489 |
| 9017868 | CIF | H2 Ni O5 S | C 1 2/c 1 | 6.8252; 7.607; 7.4587 90; 117.724; 90 | 342.794 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars Note: T = 0 C American Mineralogist, 2020, 105, 1472-1489 |
| 9017869 | CIF | H2 Ni O5 S | C 1 2/c 1 | 6.8115; 7.6122; 7.4444 90; 117.629; 90 | 341.98 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars Note: T = -80 C American Mineralogist, 2020, 105, 1472-1489 |
| 9017870 | CIF | H2 Ni O5 S | C 1 2/c 1 | 6.8037; 7.6178; 7.4371 90; 117.58; 90 | 341.658 | Talla, D.; Balla, M.; Aicher, C.; Lengauer, C. L.; Wildner, M. Structural and spectroscopic study of the kieserite-dwornikite solid-solution series, (Mg,Ni)SO4*H2O, at ambient and low temperatures, with cosmochemical implications for icy moons and Mars Note: T = -160 C American Mineralogist, 2020, 105, 1472-1489 |
| 9017871 | CIF | Ca O3 Si | P -1 | 6.697; 9.2986; 6.6501 83.458; 76.226; 69.581 | 376.722 | Brenker, F. E.; Nestola, F.; Brenker, L.; Peruzzo, L.; Harris, J. W. Origin, properties, and structure of breyite: The second most abundant mineral inclusion in super-deep diamonds American Mineralogist, 2021, 106, 38-43 |
| 9017872 | CIF | Al1.62 Ca0.22 Fe2.72 Mg3.36 Mn6.3 Na5.6 O48 P12 | P 1 21/n 1 | 12.8926; 12.4658; 10.9178 90; 97.92; 90 | 1737.93 | Yang, H.; Kobsch, A.; Gu, X.; Downs, R. T.; Xie, X. Zhanghuifenite, Na3Mn2+4Mg2Al(PO4)6, a new mineral isostructural with bobfergusonite, from the Santa Ana mine, San Luis province, Argentina American Mineralogist, 2021, 106, 1009-1015 |
| 9017873 | CIF | Ca0.42 Ce0.18 Cu6 Dy0.01 Gd0.03 H12 La0.12 Nd0.09 O21 P2.85 Pr0.02 Si0.15 Sm0.01 Y0.16 | P 63/m | 13.2197; 13.2197; 5.8591 90; 90; 120 | 886.757 | Morrison, S. M.; Domanik, K. J.; Yang, H.; Downs, R. T. Petersite-(Ce), Cu2+6Ce(PO4)3(OH)6*3H2O, a new mixite group mineral from Yavapai County, Arizona, USA The Canadian Mineralogist, 2016, 54, 1505-1511 |
| 9017874 | CIF | Ba0.946 Be4 Ca0.954 H11.684 O21.559 P4 | P 1 21/c 1 | 9.4958; 13.6758; 13.4696 90; 90.398; 90 | 1749.16 | Hatert, F.; Dal Bo, F.; Bruni, Y.; Meisser, N.; Vignola, P.; Risplendente, A.; Chatenet, F. X.; Lebocey, J. Limousinite, BaCa[Be4P4O16]*6H2O, a new beryllophosphate mineral with a phillipsite-type framework The Canadian Mineralogist, 2020, 58, 815-827 |
| 9017875 | CIF | Al0.04 Ba1.16 Ca0.55 F2.62 Fe2.56 H3.38 K0.82 Mg0.08 Mn5.04 Na1.42 Nb0.32 O35.38 Rb0.06 Si8 Ti3.68 Zn0.16 Zr0.04 | C -1 | 10.741; 13.841; 11.079 108.174; 99.186; 89.99 | 1542.67 | Sokolova, E.; Day, M. C.; Hawthorne, F. C.; Agakhanov, A. A.; Camara, F.; Uvarova, Y. A.; Della Ventura, G. From structure topology to chemical composition. XXIX. Revision of the crystal structure of perraultite, NaBaMn4Ti2(Si2O7)2O2(OH)2F, a seidozerite-supergroup TS-block mineral from the Oktyabr'skii massiff, Ukraine, and discreditation of surkhobite The Canadian Mineralogist, 2021, 59, 1-15 |
| 9017876 | CIF | Fe0.47 H7.62 Mg0.79 Mn0.1 Ni1.25 O12.81 Te3 | P 63 | 9.3667; 9.3667; 7.6173 90; 90; 120 | 578.769 | Missen, O. P.; Back, M. E.; Mills, S. J.; Roberts, A. C.; LePage, Y.; Pinch, W. W.; Mandarino, J. A. Crystal chemistry of zemannite-type structures: III. Keystoneite, the Ni2±analogue of zemannite, and ferrotellurite discredited The Canadian Mineralogist, 2021, 59, 355-364 |
| 9017877 | CIF | Ca0.81 Fe0.1 H8 Mn1.9 O17 Si4 Sr1.19 | C 1 | 9.1386; 6.2566; 12.0043 90.019; 91.643; 89.9 | 686.081 | Yang, H.; Gu, X.; Cairncross, B.; Downs, R. T.; Evans, S. H. Taniajacoite and strontioruizite, two new minerals isostructural with ruizite from the N'Chwaning III mine, Kalahari manganese field, South Africa The Canadian Mineralogist, 2021, 59, 431-444 |
| 9017878 | CIF | Ca0.41 Fe0.05 H8 Mn1.95 O17 Si4 Sr1.59 | C 1 2 1 | 9.1575; 6.2857; 12.0431 90; 91.744; 90 | 692.895 | Yang, H.; Gu, X.; Cairncross, B.; Downs, R. T.; Evans, S. H. Taniajacoite and strontioruizite, two new minerals isostructural with ruizite from the N'Chwaning III mine, Kalahari manganese field, South Africa The Canadian Mineralogist, 2021, 59, 431-444 |
| 9017879 | CIF | Al2.46 Ba0.8 Ca0.28 Fe8.58 Mg0.88 Mn1.8 Na2.64 O48 P12 | P 1 21/n 1 | 12.7156; 12.3808; 10.9347 90; 97.332; 90 | 1707.37 | Yang, H.; Yong, T.; Downs, R. T. Ferrobobfergusonite, []Na2Fe2+5Fe3+Al(PO4)6, a new mineral of the bobfergusonite group from the Victory mine, Custer County, South Dakota, USA The Canadian Mineralogist, 2021, 59, 617-627 |
| 9017880 | CIF | C0.216 H2.996 Cr0.43 Mg0.028 O3.146 Zn0.542 | R -3 m :H | 3.1111; 3.1111; 22.6816 90; 90; 120 | 190.122 | Yang, H.; Gibbs, R. B.; Schwenk, C.; Xie, X.; Gu, X.; Downs, R. T.; Evans, S. H. Liudongshengite, Zn4Cr2(OH)12(CO3)*3H2O, a new mineral of the hydrotalcite supergroup, from the 79 mine, Gila County, Arizona, USA The Canadian Mineralogist, 2021, 59, 763-769 |
| 9017881 | CIF | H2 Mg O5 S | C 1 2/c 1 | 6.91; 7.634; 7.643 90; 118; 90 | 355.983 | Bechtold, A.; Wildner, M. Crystal chemistry of the kieserite-cobaltkieserite solid solution, Mg1-xCox(SO4)*H2O: well-behaved oddities European Journal of Mineralogy, 2016, 28, 43-52 |
| 9017882 | CIF | Co0.279 H2 Mg0.721 O5 S | C 1 2/c 1 | 6.929; 7.623; 7.641 90; 118.19; 90 | 355.724 | Bechtold, A.; Wildner, M. Crystal chemistry of the kieserite-cobaltkieserite solid solution, Mg1-xCox(SO4)*H2O: well-behaved oddities Note: sample Mg0.76Co0.28 European Journal of Mineralogy, 2016, 28, 43-52 |
| 9017883 | CIF | Co0.509 H2 Mg0.491 O5 S | C 1 2/c 1 | 6.943; 7.614; 7.639 90; 118.33; 90 | 355.461 | Bechtold, A.; Wildner, M. Crystal chemistry of the kieserite-cobaltkieserite solid solution, Mg1-xCox(SO4)*H2O: well-behaved oddities Note: sample Mg0.49Co0.51 European Journal of Mineralogy, 2016, 28, 43-52 |
| 9017884 | CIF | Co0.858 H2 Mg0.142 O5 S | C 1 2/c 1 | 6.963; 7.601; 7.633 90; 118.5; 90 | 355.027 | Bechtold, A.; Wildner, M. Crystal chemistry of the kieserite-cobaltkieserite solid solution, Mg1-xCox(SO4)*H2O: well-behaved oddities Note: sample Mg0.14Co0.86 European Journal of Mineralogy, 2016, 28, 43-52 |
| 9017885 | CIF | Co H2 O5 S | C 1 2/c 1 | 6.97; 7.595; 7.632 90; 118.58; 90 | 354.787 | Bechtold, A.; Wildner, M. Crystal chemistry of the kieserite-cobaltkieserite solid solution, Mg1-xCox(SO4)*H2O: well-behaved oddities European Journal of Mineralogy, 2016, 28, 43-52 |
| 9017886 | CIF | Fe H7 O8 S | P -1 | 6.6559; 8.9161; 11.6069 97.221; 95.655; 90.412 | 679.885 | Majzlan, J.; Dachs, E.; Benisek, A.; Plasil, J.; Sejkora, J. Thermodynamics, crystal chemistry and structural complexity of the Fe(SO4)(OH)(H2O)x phases: Fe(SO4)(OH), metahohmannite, butlerite, parabutlerite, amarantite, hohmannite, and fibroferrite European Journal of Mineralogy, 2018, 30, 259-275 |
| 9017887 | CIF | Ca4 H16 O16 Si2 | C 1 2/m 1 | 16.907; 3.6528; 13.068 90; 117.25; 90 | 717.483 | Zubkova, N. V.; Pekov, I. V.; Pushcharovsky, D. Y.; Zadov, A. E.; Chukanov, N. V. The crystal structure of aklimaite, Ca4[Si2O5(OH)2](OH)4*5H2O Zeitschrift fur Kristallographie, 2012, 227, 452-455 |
| 9017888 | CIF | As0.745 Pb0.98 S4 Sb1.275 | P 1 21/n 1 | 7.997; 19.517; 8.634 90; 91.061; 90 | 1347.34 | Makovicky, E.; Topa, D. Twinnite, Pb0.8Tl0.1Sb1.3As0.8S4, the OD character and the question of its polytypism Zeitschrift fur Kristallographie, 2012, 227, 468-475 |
| 9017889 | CIF | O2 | C 1 2/m 1 | 7.97; 5.633; 3.711 90; 116.3; 90 | 149.359 | Datchi, F.; Weck, G. X-ray crystallography of simple molecular solids up to megabar pressures: application to solid oxygen and carbon dioxide Zeitschrift fur Kristallographie, 2014, 229, 135-157 |
| 9017890 | CIF | Ag10.96 Te7 | P -6 | 13.454; 13.454; 8.459 90; 90; 120 | 1326.03 | Bindi, L.; Keutsch, F. N. Old defined minerals with complex, still unresolved structures: the case of stutzite, Ag5-xTe3 Note: type sample Zeitschrift fur Kristallographie, 2018, 233, 247-253 |
| 9017891 | CIF | Al F Fe0.02 H34 Mg0.98 O25 S2 | P -1 | 6.6749; 6.773; 14.9076 79.604; 80.163; 62.475 | 584.9 | Mauro, D.; Biagioni, C.; Pasero, M.; Skogby, H. Crystal-chemistry of sulfates From the Apuan Alps (Tuscany, Italy). III. Mg-rich sulfate assemblages from the Fornovolasco mining complex Atti della Societa Toscana di Scienze Naturali, Memorie, Serie A, 2019, 126, 33-44 |
| 9017892 | CIF | Fe0.17 H14 Mg0.83 O11 S | P 21 21 21 | 11.8664; 12.015; 6.8598 90; 90; 90 | 978.035 | Mauro, D.; Biagioni, C.; Pasero, M.; Skogby, H. Crystal-chemistry of sulfates From the Apuan Alps (Tuscany, Italy). III. Mg-rich sulfate assemblages from the Fornovolasco mining complex Atti della Societa Toscana di Scienze Naturali, Memorie, Serie A, 2019, 126, 33-44 |
| 9017893 | CIF | As1.768 Fe2.686 H10.8 Na1.48 O20.36 P2 W0.664 | I m m a | 25.77; 7.325; 10.522 90; 90; 90 | 1986.19 | Grey, I. E.; Mumme, G.; Kampf, A. R.; MacRae, C. M.; Wilson, N. C. Natrowalentaite, a new mineral from the Griffins Find gold deposit, Western Australia Note: T = 100 K Australian Journal of Mineralogy, 2019, 20, 7-15 |
| 9017894 | CIF | H2 Mg O5 S | C 1 2/c 1 | 6.891; 7.624; 7.549 90; 116.25; 90 | 355.701 | Coing-Boyat J Remarques sur la structure commune de MgSO4*H2O et de CoSO4*H2O Bulletin de la Societe Chimique de France, 1971, 1971, 3863-3865 |
| 9017895 | CIF | Fe2 O12 S3 | R -3 :H | 8.229; 8.229; 22.177 90; 90; 120 | 1300.55 | Masse, R.; Guitel, J. C.; Perret, R. Structure crystalline de la variete rhomboedrique du sulfate ferrique Fe2(SO4)3 Bulletin de la Societe Francaise de Mineralogie et de Cristallographie, 1973, 96, 346-349 |
| 9017897 | CIF | Fe0.038 Mg1.962 O4 Si | P m m a | 5.802; 2.905; 8.411 90; 90; 90 | 141.766 | Tomioka, N.; Bindi, L.; Okuchi, T.; Miyahara, M.; Iitaka, T.; Li, Z.; Kawatsu, T.; Xie, X.; Purevjav, N.; Tani, R.; Kodama, Y. Poirierite, a dense metastable polymorph of magnesium iron silicate in shocked meteorites Communications Earth & Environment, 2021, 2 |
| 9017898 | CIF | Co H2 O5 S | C 1 2/c 1 | 6.963; 7.58; 7.47 90; 116.358; 90 | 353.275 | Le Fur, Y.; Coing-Boyat J; Bassi, G. Structure des sulfates monohydrates, monocliniques, des metaux de transition, MSO4*H2O (M = Mn, Fe, Co, Ni et Zn) Comptes Rendus de l'Academie des Sciences Paris, 1966, 632-635 |
| 9017899 | CIF | Co H2 O5 S | C 1 2/c 1 | 6.963; 7.58; 7.47 90; 116.358; 90 | 353.275 | Le Fur, Y.; Coing-Boyat J; Bassi, G. Structure des sulfates monohydrates, monocliniques, des metaux de transition, MSO4*H2O (M = Mn, Fe, Co, Ni et Zn) Comptes Rendus de l'Academie des Sciences Paris, 1966, 632-635 |
| 9017900 | CIF | H2 Ni O5 S | C 1 2/c 1 | 6.827; 7.595; 7.4 90; 116.892; 90 | 342.205 | Le Fur, Y.; Coing-Boyat J; Bassi, G. Structure des sulfates monohydrates, monocliniques, des metaux de transition, MSO4*H2O (M = Mn, Fe, Co, Ni et Zn) Comptes Rendus de l'Academie des Sciences Paris, 1966, 632-635 |
| 9017901 | CIF | H2 O5 S Zn | C 1 2/c 1 | 6.93; 7.584; 7.503 90; 116.233; 90 | 353.721 | Le Fur, Y.; Coing-Boyat J; Bassi, G. Structure des sulfates monohydrates, monocliniques, des metaux de transition, MSO4*H2O (M = Mn, Fe, Co, Ni et Zn) Comptes Rendus de l'Academie des Sciences Paris, 1966, 632-635 |
| 9017902 | CIF | Fe H2 O5 S | C 1 2/c 1 | 7.075; 7.541; 7.6 90; 116.183; 90 | 363.873 | Le Fur, Y.; Coing-Boyat J; Bassi, G. Structure des sulfates monohydrates, monocliniques, des metaux de transition, MSO4*H2O (M = Mn, Fe, Co, Ni et Zn) Comptes Rendus de l'Academie des Sciences Paris, 1966, 632-635 |
| 9017903 | CIF | H2 Mn O5 S | C 1 2/c 1 | 7.124; 7.663; 7.764 90; 115.85; 90 | 381.436 | Le Fur, Y.; Coing-Boyat J; Bassi, G. Structure des sulfates monohydrates, monocliniques, des metaux de transition, MSO4*H2O (M = Mn, Fe, Co, Ni et Zn) Comptes Rendus de l'Academie des Sciences Paris, 1966, 632-635 |
| 9017904 | CIF | Fe H14.1 K4 Na10 O50.3 Si16 | C m c m | 28.866; 10.707; 17.425 90; 90; 90 | 5385.51 | Panikorovskii, T. L.; Pekov, I. V.; Krzhizhanovskaya, M. G.; Yakovenchuk, V. N.; Britven, S. N.; Gurzhiy, V. V.; Bocharov, V. N.; Yapaskurt, V. O.; Krivovichev, S. V. Tiettaite K4Na12Fe3+Si16O41(OH)4·2H2O: A mineral with a novel type of microporous heteropolyhedral framework Crystallography Reports, 2021, 66, 76-85 |
| 9017905 | CIF | C4 H6 N4 O3 | P 1 21/c 1 | 8.0004; 5.1487; 14.7501 90; 92.908; 90 | 606.799 | Xu, B.; Sung, C.; Han, B. Crystal structure characterization of natural allantoin from edible lichen Umbilicaria esculenta Note: T = 232 K Crystals, 2011, 1, 128-135 |
| 9017906 | CIF | As5.79 Fe0.15 Ni14.25 Sb0.06 | P 63 c m | 6.7922; 6.7922; 12.4975 90; 90; 120 | 499.315 | Bindi, L.; Tredoux, M.; Zaccarini, F.; Miller, D. E.; Garuti, G. Non-stoichiometric nickel arsenides in nature: The structure of orcelite, Ni5-xAs2 (x = 0.25), from the Bon Accord oxide body, South Africa Journal of Alloys and Compounds, 2014, 601, 175-178 |
| 9017907 | CIF | C19 O8 | P 21 21 21 | 9.837; 10.517; 18.7594 90; 90; 90 | 1940.77 | Lisgarte, J. N.; Potter, B.; Palmer, R. A.; Chimanuka, B.; Aymami, J. Structure, absolute configuration, and conformation of the antimalarial drug artesunate Journal of Chemical Crystallography, 2002, 32, 43-48 |
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