Crystallography Open Database
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COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1543734 | CIF | C20 H17 N O4 S2 | P 1 21/c 1 | 14.0128; 8.8244; 16.431 90; 112.361; 90 | 1879 | Yang, Daoshan; Sun, Mingyang; Wei, Wei; Li, Jin; Sun, Pengfei; Zhang, Qingyun; Tian, Laijin; Wang, Hua Copper-catalyzed decarboxylative stereospecific amidation of cinnamic acids with N-fluorobenzenesulfonimide RSC Advances, 2016, 6, 72361-72365 |
| 1543935 | CIF | C27 H33 Cl Cu F3 N5 O7 | P -1 | 9.4109; 11.7658; 15.5101 77.188; 80.638; 67.2 | 1538.14 | Xiao, Ying; Xu, Kailin; Wang, Qing; Xiong, Xinnuo; Huang, Yanmei; Li, Hui Synthesis, structure, and calf-thymus DNA binding of ternary fleroxacin–Cu( <scp>ii</scp> ) complexes RSC Advances, 2016, 6, 80286-80295 |
| 1543975 | CIF | C35 H40.5 O15.25 | P 21 21 21 | 10.2921; 12.3711; 26.3067 90; 90; 90 | 3349.49 | Dai, Yi-Guo; Li, Wan-Shan; Pedpradab, Patchara; Liu, Jun-Jun; Wu, Jun; Shen, Li Thaixylomolins O–R: four new limonoids from the Trang mangrove, Xylocarpus moluccensis RSC Advances, 2016, 6, 85978-85984 |
| 1543976 | CIF | C30 H38 O11 | P 1 21 1 | 12.4747; 8.9839; 13.2402 90; 107.131; 90 | 1418.02 | Dai, Yi-Guo; Li, Wan-Shan; Pedpradab, Patchara; Liu, Jun-Jun; Wu, Jun; Shen, Li Thaixylomolins O–R: four new limonoids from the Trang mangrove, Xylocarpus moluccensis RSC Advances, 2016, 6, 85978-85984 |
| 1544176 | CIF | C20 H15 B F2 O4 | P -1 | 8.808; 13.609; 14.247 76.62; 87.56; 88.26 | 1659.53 | Liu, Chun; Zhang, Hao; Zhao, Jianzhang Synthesis, characterization and properties of furan-containing difluoroboron complexes RSC Advances, 2016, 6, 92341-92348 |
| 1544177 | CIF | C23 H15 B F2 O3 | P 1 21/c 1 | 16.88; 9.056; 11.782 90; 97.5; 90 | 1785.65 | Liu, Chun; Zhang, Hao; Zhao, Jianzhang Synthesis, characterization and properties of furan-containing difluoroboron complexes RSC Advances, 2016, 6, 92341-92348 |
| 1544178 | CIF | C35 H35 Co2 N5 O9 | P 41 21 2 | 10.848; 10.848; 29.771 90; 90; 90 | 3503.4 | Satska, Yulia A.; Mikhalyova, Elena A.; Chernenko, Zhanna V.; Kolotilov, Sergey V.; Zeller, Matthias; Komarov, Igor V.; Tymtsunik, Andriy V.; Tolmachev, Andrey; Gavrilenko, Konstantin S.; Addison, Anthony W. Sorption discrimination between secondary alcohol enantiomers by chiral alkyl-dicarboxylate MOFs RSC Advances, 2016, 6, 93707-93714 |
| 1544179 | CIF | C48 H36 N7 O8 S2 | P -1 | 6.817; 18.957; 20.898 103.091; 90.526; 94.227 | 2622 | Shweta, Shweta; Kumar, Ajit; Neeraj, Neeraj; Asthana, Sharad Kumar; Prakash, Anand; Roy, Jagat Kumar; Tiwari, Ida; Upadhyay, K. K. A highly sensitive naphthaoxazole-based cell-permeable ratiometric chemodosimeter for hydrazine RSC Advances, 2016, 6, 94959-94966 |
| 7223536 | CIF | C84 H89.5 Fe2 N20 O8.75 | A e a 2 | 14.6547; 34.5808; 35.0669 90; 90; 90 | 17770.9 | Papadakis, Raffaello; Deligkiozi, Ioanna; Giorgi, Michel; Faure, Bruno; Tsolomitis, Athanase Supramolecular complexes involving non-symmetric viologen cations and hexacyanoferrate(II) anions. A spectroscopic, crystallographic and computational study. RSC Advances, 2015, 6, 575-585 |
| 7223607 | CIF | C16 H16 N2 O5 | P -1 | 7.3305; 10.614; 11.3269 67.359; 80.119; 81.565 | 798.16 | da Silva, Michael J. V.; Silva, Raí G. M.; Melo, Ulisses Z.; Gonçalves, Davana S.; Back, Davi F.; Moura, Sidnei; Pontes, Rodrigo M.; Basso, Ernani A.; Gauze, Gisele F.; Rosa, Fernanda A. Theoretical and experimental investigation of the polyeletrophilic β-enamino diketone: straightforward and highly regioselective synthesis of 1,4,5-trisubstituted pyrazoles and pyrazolo[3,4-d]pyridazinones RSC Adv., 2016, 6, 290 |
| 7223620 | CIF | C26 H23 N2 O5 S | P -1 | 11.126; 11.135; 11.58 64.26; 64.9; 89.98 | 1140.1 | Zhou, Qing-Fa; Ge, Fei-Fei; Chen, Qing-Qing; Lu, Tao Construction of pyrazolo[5,1-a]isoindol-8(3aH)-one derivatives via phosphine-catalyzed cyclization of electron-deficient alkynes and N-amino substituted phthalimide RSC Adv., 2016, 6, 1395 |
| 7223771 | CIF | C18 H22 K N O5 S | P 1 21/c 1 | 23.671; 8.6038; 9.53 90; 99.236; 90 | 1915.7 | Cardona, Maria A.; Mallia, Carl J.; Baisch, Ulrich; Magri, David C. Water-soluble amino(ethanesulfonate) and [bis(ethanesulfonate)] anthracenes as fluorescent photoinduced electron transfer (PET) pH indicators and Fe3+chemosensors RSC Adv., 2016, 6, 3783 |
| 7223890 | CIF | C11 H23 N O5 P | P 1 21/c 1 | 10.3979; 13.6246; 13.7301 90; 130.745; 90 | 1473.65 | Audran, Gérard; Bosco, Lionel; Brémond, Paul; Butscher, Teddy; Franconi, Jean-Michel; Kabitaev, Kuanysh; Marque, Sylvain R. A.; Mellet, Philippe; Parzy, Elodie; Santelli, Maurice; Thiaudière, Eric; Viel, Stéphane β-Phosphorus hyperfine coupling constant in nitroxides: 5. Solvent effect RSC Adv., 2016, 6, 5653 |
| 7223929 | CIF | C44 H54 Br4 N2 | P 1 21/n 1 | 8.3338; 29.562; 9.0991 90; 114.598; 90 | 2038.3 | Chen, Shiyan; Ni, Xin-Long Development of an AIE based fluorescent probe for the detection of nitrate anions in aqueous solution over a wide pH range RSC Adv., 2016, 6, 6997 |
| 7223944 | CIF | C26 H28 Cl2 N4 O2 S3 | P 1 21/c 1 | 14.3594; 22.1059; 8.8264 90; 104.71; 90 | 2709.91 | Wiles, Alan A.; Fitzpatrick, Brian; McDonald, Niall A.; Westwater, Mary Margaret; Long, De-Liang; Ebenhoch, Bernd; Rotello, Vincent M.; Samuel, Ifor D. W.; Cooke, Graeme Synthesis and properties of pteridine-2,4-dione-functionalised oligothiophenes RSC Adv., 2016, 6, 7999 |
| 7223945 | CIF | C25 H25 Br N4 O2 S3 | P 1 21/c 1 | 14.7336; 18.2084; 9.4057 90; 94.715; 90 | 2514.8 | Wiles, Alan A.; Fitzpatrick, Brian; McDonald, Niall A.; Westwater, Mary Margaret; Long, De-Liang; Ebenhoch, Bernd; Rotello, Vincent M.; Samuel, Ifor D. W.; Cooke, Graeme Synthesis and properties of pteridine-2,4-dione-functionalised oligothiophenes RSC Adv., 2016, 6, 7999 |
| 7223946 | CIF | C12 H14 Br N O5 | P 21 21 21 | 5.837; 9.2077; 25.6068 90; 90; 90 | 1376.25 | Lin, Chia-Hsin; Hong, Bor-Cherng; Lee, Gene-Hsiang Asymmetric synthesis of functionalized pyrrolizidines by an organocatalytic and pot-economy strategy RSC Adv., 2016, 6, 8243 |
| 7223947 | CIF | C14 H16 Cl N O | P 21 21 21 | 7.6652; 7.8614; 20.6346 90; 90; 90 | 1243.42 | Lin, Chia-Hsin; Hong, Bor-Cherng; Lee, Gene-Hsiang Asymmetric synthesis of functionalized pyrrolizidines by an organocatalytic and pot-economy strategy RSC Adv., 2016, 6, 8243 |
| 7223948 | CIF | C20 H32 N4 Se2 Sn | P -1 | 11.659; 16.166; 29.13 84.62; 84.17; 70.44 | 5136 | Tyagi, Adish; Kedarnath, G.; Wadawale, Amey; Shah, Alpa Y.; Jain, Vimal K.; Vishwanadh, B. Diorganotin(iv) 4,6-dimethyl-2-pyrimidyl selenolates: synthesis, structures and their utility as molecular precursors for the preparation of SnSe2nano-sheets and thin films RSC Adv., 2016, 6, 8367 |
| 7223949 | CIF | C20 H32 N4 Se2 Sn | C 1 2/c 1 | 14.8; 7.749; 21.526 90; 95.42; 90 | 2457.7 | Tyagi, Adish; Kedarnath, G.; Wadawale, Amey; Shah, Alpa Y.; Jain, Vimal K.; Vishwanadh, B. Diorganotin(iv) 4,6-dimethyl-2-pyrimidyl selenolates: synthesis, structures and their utility as molecular precursors for the preparation of SnSe2nano-sheets and thin films RSC Adv., 2016, 6, 8367 |
| 7223950 | CIF | C14 H25 Cl N2 Se Sn | P 1 21/c 1 | 9.192; 12.655; 15.99 90; 92.278; 90 | 1858.6 | Tyagi, Adish; Kedarnath, G.; Wadawale, Amey; Shah, Alpa Y.; Jain, Vimal K.; Vishwanadh, B. Diorganotin(iv) 4,6-dimethyl-2-pyrimidyl selenolates: synthesis, structures and their utility as molecular precursors for the preparation of SnSe2nano-sheets and thin films RSC Adv., 2016, 6, 8367 |
| 7223991 | CIF | C18 H10 N4 | C 1 2/c 1 | 22.8914; 5.7531; 23.238 90; 113.464; 90 | 2807.3 | Bhowmick, Sourav; Chakraborty, Sourav; Marri, Subba R.; Behera, J. N.; Das, Neeladri Pyrazine-based donor tectons: synthesis, self-assembly and characterization RSC Adv., 2016, 6, 8992 |
| 7224159 | CIF | C68 H47 N7 O Zn | P 1 21/c 1 | 13.1741; 20.85; 19.578 90; 102.558; 90 | 5249 | Lanzilotto, Angelo; Büldt, Laura A.; Schmidt, Hauke C.; Prescimone, Alessandro; Wenger, Oliver S.; Constable, Edwin C.; Housecroft, Catherine E. Improved light absorbance does not lead to better DSC performance: studies on a ruthenium porphyrin‒terpyridine conjugate RSC Adv., 2016, 6, 15370 |
| 7224162 | CIF | C183 H190 N24 O64 S8 | C 1 2/c 1 | 21.5619; 11.3649; 18.9777 90; 93.367; 90 | 4642.4 | Lega, Dmitry A.; Gorobets, Nikolay Yu.; Chernykh, Valentine P.; Shishkina, Svetlana V.; Shemchuk, Leonid A. Peculiarities of 2-amino-3-R-4-aryl-4H-pyranes multicomponent synthesis derived from 1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide RSC Adv., 2016, 6, 16087 |
| 7224163 | CIF | C33 H40 N4 O8 S2 | P n a 21 | 13.1522; 23.4963; 11.0242 90; 90; 90 | 3406.8 | Lega, Dmitry A.; Gorobets, Nikolay Yu.; Chernykh, Valentine P.; Shishkina, Svetlana V.; Shemchuk, Leonid A. Peculiarities of 2-amino-3-R-4-aryl-4H-pyranes multicomponent synthesis derived from 1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide RSC Adv., 2016, 6, 16087 |
| 7224164 | CIF | C16 H17 N3 O5 | P 1 21/c 1 | 15.2726; 11.581; 9.1189 90; 95.023; 90 | 1606.68 | Oruganti, Madhavi; Khade, Pavan; Das, Uttam Kumar; Trivedi, Darshak R. The hierarchies of hydrogen bonds in salts/cocrystals of isoniazid and its Schiff base ‒ a case study RSC Adv., 2016, 6, 15868 |
| 7224165 | CIF | C20 H19 N3 O9 | P -1 | 7.6313; 7.8438; 17.8835 81.836; 88.72; 64.742 | 957.45 | Oruganti, Madhavi; Khade, Pavan; Das, Uttam Kumar; Trivedi, Darshak R. The hierarchies of hydrogen bonds in salts/cocrystals of isoniazid and its Schiff base ‒ a case study RSC Adv., 2016, 6, 15868 |
| 7224166 | CIF | C16 H18 N4 O3 | P 1 21/c 1 | 8.7707; 20.4025; 9.1687 90; 100.514; 90 | 1613.14 | Oruganti, Madhavi; Khade, Pavan; Das, Uttam Kumar; Trivedi, Darshak R. The hierarchies of hydrogen bonds in salts/cocrystals of isoniazid and its Schiff base ‒ a case study RSC Adv., 2016, 6, 15868 |
| 7224167 | CIF | C14 H2 N3 O5 | P -1 | 6.9555; 9.2797; 11.0293 97.828; 99.815; 100.154 | 680.26 | Oruganti, Madhavi; Khade, Pavan; Das, Uttam Kumar; Trivedi, Darshak R. The hierarchies of hydrogen bonds in salts/cocrystals of isoniazid and its Schiff base ‒ a case study RSC Adv., 2016, 6, 15868 |
| 7224186 | CIF | C8 H32 Ge2 N8 O S6 V2 | P 1 21/n 1 | 8.3522; 12.682; 11.339 90; 94.75; 90 | 1196.9 | Qian, Li-Wen; Zhao, Xiao-Wei; Su, Hu-Chao; Bian, Guo-Qing; Zhu, Qin-Yu; Dai, Jie Supramolecular hexagonal nano tubes assembled by vanadium diamine complexes with thiogermanates RSC Adv., 2016, 6, 16268 |
| 7224187 | CIF | C12 H40 Ge2 N8 O2 S6 V2 | R -3 c :H | 38.284; 38.284; 11.17 90; 90; 120 | 14178 | Qian, Li-Wen; Zhao, Xiao-Wei; Su, Hu-Chao; Bian, Guo-Qing; Zhu, Qin-Yu; Dai, Jie Supramolecular hexagonal nano tubes assembled by vanadium diamine complexes with thiogermanates RSC Adv., 2016, 6, 16268 |
| 7224296 | CIF | C44 H64 B2 Ge2 N6 | P -1 | 8.993; 11.414; 11.9331 112.083; 94.293; 107.174 | 1060.25 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224297 | CIF | C22 H34 B N3 | P -1 | 8.6562; 10.284; 12.9948 73.067; 86.43; 76.579 | 1076.41 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224298 | CIF | C34 H42 B Ge N3 Se2 | P 1 21/c 1 | 20.425; 8.554; 19.569 90; 90.855; 90 | 3418.6 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224299 | CIF | C54 H82 B Ge N5 | P -1 | 12.41; 15.971; 26.276 101.799; 95.207; 98.138 | 5007.9 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224300 | CIF | C34 H42 B Ge N3 Te2 | P b c a | 8.334; 19.705; 42.118 90; 90; 90 | 6916.7 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224301 | CIF | C34 H42 B Ge N3 S2 | P 1 21/c 1 | 20.0901; 8.496; 19.6849 90; 91.921; 90 | 3358 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224302 | CIF | C28 H42 B Ge N3 | P -1 | 8.404; 10.24; 17.1711 99.375; 92.648; 107.632 | 1382.27 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224303 | CIF | C22 H32 B Ge I2 N3 | P 1 21/c 1 | 14.72; 8.214; 21.3591 90; 94.762; 90 | 2573.6 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224304 | CIF | C23 H35 B Ge I N3 | P -1 | 8.404; 11.041; 13.8139 84.933; 80.365; 89.771 | 1258.68 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224305 | CIF | C40 H50 B Ge N3 | P 1 21/c 1 | 13.726; 19.8081; 14.794 90; 117.858; 90 | 3556.1 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224306 | CIF | C22 H33 B Cl Ge N3 | P -1 | 8.467; 9.7781; 14.5579 79.339; 76.99; 79.439 | 1141.36 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224307 | CIF | C22 H33 B Br3 Ge N3 | P -1 | 9.48; 9.529; 31.902 86.052; 86.293; 65.709 | 2618.4 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224308 | CIF | C22 H33 B Br Ge N3 | P -1 | 8.352; 10.479; 13.5181 95.684; 100.864; 90.338 | 1155.83 | Böserle, Jiří; Alonso, Mercedes; Jambor, Roman; Růžička, Aleš; Dostál, Libor Synthesis and reactivity of a germylene stabilized by a boraguanidinate ligand RSC Adv., 2016, 6, 19377 |
| 7224373 | CIF | C112 H174 Na6 Ni4 O42 Si12 | P -1 | 14.7272; 15.6359; 16.932 113.914; 96.98; 95.989 | 3486.8 | Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M. Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom RSC Adv., 2016, 6, 22052 |
| 7224374 | CIF | C60 H96 O12 Si12 | P -1 | 12.919; 13.675; 23.8149 76.271; 77.6651; 74.0613 | 3880 | Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M. Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom RSC Adv., 2016, 6, 22052 |
| 7224375 | CIF | C95.6 H119 Cu4 Na4 O29.8 Si12 | C 1 2/c 1 | 24.6412; 19.7915; 27.463 90; 113.73; 90 | 12261 | Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M. Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom RSC Adv., 2016, 6, 22052 |
| 7224376 | CIF | C129 H210 O24 Si24 | P -1 | 18.511; 19.755; 26.771 71.01; 88.51; 62.94 | 8157 | Anisimov, Anton A.; Kononevich, Yuriy N.; Zhemchugov, Pavel V.; Milenin, Sergey A.; Korlyukov, Alexander A.; Tsareva, Ul'yana S.; Peregudov, Alexander S.; Dorovatovskii, Pavel V.; Molodtsova, Yuliya A.; Takazova, Rina U.; Shchegolikhina, Olga I.; Muzafarov, Aziz M. Synthesis and structure of new polyhedral Ni, Na- and Cu, Na-metallasiloxanes with tolyl substituent at the silicon atom RSC Adv., 2016, 6, 22052 |
| 7224380 | CIF | C44 H60 N8 O6 Ti2 | C 1 2/c 1 | 11.1634; 24.517; 17.6569 90; 94.801; 90 | 4815.6 | Mandal, Dipa; Chakraborty, Debashis; Ramkumar, Venkatachalam; Chand, Dillip Kumar Group 4 alkoxide complexes containing [NNO]-type scaffold: synthesis, structural characterization and polymerization studies RSC Adv., 2016, 6, 21706 |
| 7224381 | CIF | C48 H68 Cl4 N8 O6 Zr2 | P -1 | 9.9338; 11.1209; 14.56 106.403; 91.013; 108.188 | 1456 | Mandal, Dipa; Chakraborty, Debashis; Ramkumar, Venkatachalam; Chand, Dillip Kumar Group 4 alkoxide complexes containing [NNO]-type scaffold: synthesis, structural characterization and polymerization studies RSC Adv., 2016, 6, 21706 |
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