Crystallography Open Database

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1519699 CIFC40 H46 Cl8 Co5 N18P -111.5936; 11.9201; 12.1223
63.593; 88.025; 67.331		1365.41Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
RSC Advances, 2015, 5, 48596-48606
1519700 CIFC30.5 H18 Co3 N8 O8.5P -19.2529; 10.6355; 11.0493
63.622; 86.489; 74.907		938.7Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
RSC Advances, 2015, 5, 48596-48606
1519701 CIFC28 H22 Co N16 O2P 1 21/n 19.2567; 15.269; 10.2578
90; 96.72; 90		1439.9Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
RSC Advances, 2015, 5, 48596-48606
1519702 CIFC28 H22 N16 Ni O2P 1 21/n 19.1787; 15.2181; 10.3355
90; 96.657; 90		1434Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
RSC Advances, 2015, 5, 48596-48606
1519703 CIFC14 H8 Cu2 N8 OP b c n14.6978; 19.3933; 10.356
90; 90; 90		2951.9Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
RSC Advances, 2015, 5, 48596-48606
1519704 CIFC14 H16 Mn N8 O4I 41/a c d19.1314; 19.1314; 20.6667
90; 90; 90		7564.2Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
RSC Advances, 2015, 5, 48596-48606
1520261 CIFC20 H20 Cl F N4 O3P n a 2122.318; 10.108; 9.029
90; 90; 90		2036.9Areias, L. R. P.; Ruivo, E. F. P.; Gonçalves, L. M.; Duarte, M. T.; André, V.; Moreira, R.; Lucas, S. D.; Guedes, R. C.
A unified approach toward the rational design of selective low nanomolar human neutrophil elastase inhibitors
RSC Advances, 2015, 5, 51717-51721
1520262 CIFC14 H18 N2 O4 SP 21 21 216.702; 11.902; 18.892
90; 90; 90		1507Areias, L. R. P.; Ruivo, E. F. P.; Gonçalves, L. M.; Duarte, M. T.; André, V.; Moreira, R.; Lucas, S. D.; Guedes, R. C.
A unified approach toward the rational design of selective low nanomolar human neutrophil elastase inhibitors
RSC Advances, 2015, 5, 51717-51721
1520263 CIFC16 H18 N4 O2 SP 1 21 18.2251; 10.3695; 9.9358
90; 94.251; 90		845.095Deshpande, Sudhindra H.; Shende, Vaishali S.; Shingote, Savita K.; Chakravarty, Debamitra; Puranik, Vedavati G.; Chaudhari, Raghunath V.; Kelkar, Ashutosh A.
Rhodium complex with unsymmetrical vicinal diamine ligand: excellent catalyst for asymmetric transfer hydrogenation of ketones
RSC Advances, 2015, 5, 51722-51729
1529481 CIF
HKL		Er0.24 Gd6.96 O48 W12 Yb0.8C 1 2/c 17.65407; 11.41403; 11.39088
90; 109.744; 90		936.65Mengyan Yin; Yangai Liu; Lefu Mei; Maxim S. Molokeev; Zhaohui Huang; Minghao Fang
Preparation, crystal structure and up-conversion luminescence of Er3+, Yb3+ co-doped Gd2(WO4)3
RSC Advances, 2015, 5, 73077-73082
1540410 CIFC142 H120 Gd7 N11 O24P -115.5132; 20.762; 24.831
106.288; 103.085; 105.827		6977.1Mazarakioti, Eleni C.; Cunha-Silva, Luís; Bekiari, Vlasoula; Escuer, Albert; Stamatatos, Theocharis C.
New structural topologies in 4f-metal cluster chemistry from vertex-sharing butterfly units: {LnIII7} complexes exhibiting slow magnetization relaxation and ligand-centred emissions
RSC Advances, 2015, 5, 92534-92538
1540411 CIFC23 H20 N2 OP -19.7936; 10.0349; 10.3079
110.403; 101.163; 102.888		883.8Dandia, Anshu; Sharma, Amit; Parewa, Vijay; Kumawat, Begraj; Rathore, Kuldeep S.; Sharma, Amit
Amidic C–N bond cleavage of isatin: chemoselective synthesis of pyrrolo[2,3,4- <i>kl</i> ]acridin-1-ones using Ag NPs decorated rGO composite as an efficient and recoverable catalyst under microwave irradiation
RSC Advances, 2015, 5, 91888-91902
1540412 CIFC29 H24 N2 O2 SeP 21 21 218.7794; 14.6701; 37.5122
90; 90; 90		4831.4Chang, Wong-Jin; Kulkarni, Manohar V.; Sun, Chung-Ming
Regioselective one-pot three component synthesis of chiral 2-iminoselenazolines under sonication
RSC Advances, 2015, 5, 97113-97120
1540413 CIFC31 H28 N2 O3 SeP 1 21 18.6504; 9.7776; 16.3783
90; 98.688; 90		1369.38Chang, Wong-Jin; Kulkarni, Manohar V.; Sun, Chung-Ming
Regioselective one-pot three component synthesis of chiral 2-iminoselenazolines under sonication
RSC Advances, 2015, 5, 97113-97120
1540414 CIFC22 H23 Br N2 O2 S SeP 1 21 111.244; 7.6728; 12.837
90; 98.983; 90		1093.9Chang, Wong-Jin; Kulkarni, Manohar V.; Sun, Chung-Ming
Regioselective one-pot three component synthesis of chiral 2-iminoselenazolines under sonication
RSC Advances, 2015, 5, 97113-97120
1540415 CIFC16 H15 N SeP 1 21/n 114.8679; 10.004; 18.5854
90; 98.871; 90		2731.3Chang, Wong-Jin; Kulkarni, Manohar V.; Sun, Chung-Ming
Regioselective one-pot three component synthesis of chiral 2-iminoselenazolines under sonication
RSC Advances, 2015, 5, 97113-97120
7218992 CIFC29 H26 NP 1 21/c 112.919; 9.577; 17.878
90; 93.149; 90		2208.6Hua, Wanming; Liu, Zhi; Duan, Lian; Dong, Guifang; Qiu, Yong; Zhang, Baojie; Cui, Deliang; Tao, Xutang; Cheng, Na; Liu, Yongjun
Deep-blue electroluminescence from nondoped and doped organic light-emitting diodes (OLEDs) based on a new monoaza[6]helicene
RSC Adv., 2014, 5, 75
7219012 CIFC7 H11 Co N Na O6P 21 21 218.3415; 9.3745; 13.544
90; 90; 90		1059.11Li, Qipeng; Jiang, Xiang; Du, Shaowu
Solvent-dependent assemblies, structure diversities and magnetic properties of two homochiral Co(ii)/Na(i) coordination polymers
RSC Adv., 2014, 5, 1785
7219013 CIFC7 H14 Co N Na O7P 21 21 217.0082; 12.1505; 13.9281
90; 90; 90		1186.02Li, Qipeng; Jiang, Xiang; Du, Shaowu
Solvent-dependent assemblies, structure diversities and magnetic properties of two homochiral Co(ii)/Na(i) coordination polymers
RSC Adv., 2014, 5, 1785
7219057 CIFC23 H35 Cl2 N5 PdP 1 21/c 19.8954; 13.9545; 17.7018
90; 96.711; 90		2427.61Qi, Miao; Tan, Pei Zi; Xue, Fei; Malhi, Haripal Singh; Zhang, Zhong-Xing; Young, David J.; Hor, T. S. Andy
A supramolecular recyclable catalyst for aqueous Suzuki‒Miyaura coupling
RSC Adv., 2014, 5, 3590
7219161 CIFC34 H32 N2 S2P -17.615; 9.543; 10.259
83.045; 77.14; 81.412		715.7Wen, Shuguang; Liu, Jie; Qiu, Meng; Li, Yonghai; Zhu, Dangqiang; Gu, Chuantao; Han, Liangliang; Yang, Renqiang
Synthesis and photophysical properties of amino-substituted benzodithiophene-based fluorophores
RSC Adv., 2014, 5, 5875
7219245 CIFC34 H30 O2P 1 21/c 118.815; 15.629; 8.851
90; 103.255; 90		2533Feng, Xing; Hu, Jian-Yong; Tomiyasu, Hirotsugu; Tao, Zhu; Redshaw, Carl; Elsegood, Mark R. J.; Horsburgh, Lynne; Teat, Simon J.; Wei, Xian-Fu; Yamato, Takehiko
Iron(iii) bromide catalyzed bromination of 2-tert-butylpyrene and corresponding position-dependent aryl-functionalized pyrene derivatives
RSC Adv., 2014, 5, 8835
7219246 CIFC48 H42 O4P -112.642; 12.96; 13.854
86.048; 67.354; 60.942		1811.4Feng, Xing; Hu, Jian-Yong; Tomiyasu, Hirotsugu; Tao, Zhu; Redshaw, Carl; Elsegood, Mark R. J.; Horsburgh, Lynne; Teat, Simon J.; Wei, Xian-Fu; Yamato, Takehiko
Iron(iii) bromide catalyzed bromination of 2-tert-butylpyrene and corresponding position-dependent aryl-functionalized pyrene derivatives
RSC Adv., 2014, 5, 8835
7219247 CIFC27 H24 OP b c a34.643; 11.0927; 10.1811
90; 90; 90		3912.4Feng, Xing; Hu, Jian-Yong; Tomiyasu, Hirotsugu; Tao, Zhu; Redshaw, Carl; Elsegood, Mark R. J.; Horsburgh, Lynne; Teat, Simon J.; Wei, Xian-Fu; Yamato, Takehiko
Iron(iii) bromide catalyzed bromination of 2-tert-butylpyrene and corresponding position-dependent aryl-functionalized pyrene derivatives
RSC Adv., 2014, 5, 8835
7219248 CIFC41 H36 O3P 1 21/c 19.136; 17.638; 19.524
90; 98.252; 90		3113.5Feng, Xing; Hu, Jian-Yong; Tomiyasu, Hirotsugu; Tao, Zhu; Redshaw, Carl; Elsegood, Mark R. J.; Horsburgh, Lynne; Teat, Simon J.; Wei, Xian-Fu; Yamato, Takehiko
Iron(iii) bromide catalyzed bromination of 2-tert-butylpyrene and corresponding position-dependent aryl-functionalized pyrene derivatives
RSC Adv., 2014, 5, 8835
7219249 CIFC41 H36 N0 O3P -110.299; 12.845; 13.482
111.174; 103.142; 102.291		1531.7Feng, Xing; Hu, Jian-Yong; Tomiyasu, Hirotsugu; Tao, Zhu; Redshaw, Carl; Elsegood, Mark R. J.; Horsburgh, Lynne; Teat, Simon J.; Wei, Xian-Fu; Yamato, Takehiko
Iron(iii) bromide catalyzed bromination of 2-tert-butylpyrene and corresponding position-dependent aryl-functionalized pyrene derivatives
RSC Adv., 2014, 5, 8835
7219250 CIFC48 H42 O4P 1 21/n 117.5703; 8.8286; 24.0368
90; 101.19; 90		3657.7Feng, Xing; Hu, Jian-Yong; Tomiyasu, Hirotsugu; Tao, Zhu; Redshaw, Carl; Elsegood, Mark R. J.; Horsburgh, Lynne; Teat, Simon J.; Wei, Xian-Fu; Yamato, Takehiko
Iron(iii) bromide catalyzed bromination of 2-tert-butylpyrene and corresponding position-dependent aryl-functionalized pyrene derivatives
RSC Adv., 2014, 5, 8835
7219304 CIFC29 H29 Cl2 N3 O Ru SR -3 :H25.875; 25.875; 25.597
90; 90; 120		14842Yuan, Zeli; Shen, Xiaomin; Huang, Jiandong
Syntheses, crystal structures and antimicrobial activities of Cu(ii), Ru(ii), and Pt(ii) compounds with an anthracene-containing tripodal ligand
RSC Adv., 2015, 5, 10521
7219305 CIFC27 H23 Cl F6 N3 P PtP -18.2692; 11.1553; 14.9524
72.155; 81.81; 83.298		1295.63Yuan, Zeli; Shen, Xiaomin; Huang, Jiandong
Syntheses, crystal structures and antimicrobial activities of Cu(ii), Ru(ii), and Pt(ii) compounds with an anthracene-containing tripodal ligand
RSC Adv., 2015, 5, 10521
7219306 CIFC27 H25 Cl2 Cu N3 OP n a 2120.6261; 14.7505; 8.7896
90; 90; 90		2674.19Yuan, Zeli; Shen, Xiaomin; Huang, Jiandong
Syntheses, crystal structures and antimicrobial activities of Cu(ii), Ru(ii), and Pt(ii) compounds with an anthracene-containing tripodal ligand
RSC Adv., 2015, 5, 10521
7219320 CIFC16 H11 Cl2 O2P 1 21/c 111.158; 12.352; 12.264
90; 120.845; 90		1451.2Han, Xin; Wu, Haoming; Dong, Chune; Tien, Po; Xie, Wei; Wu, Shuwen; Zhou, Hai-Bing
Halolactones are potent HIV-1 non-nucleoside reverse transcriptase inhibitors
RSC Adv., 2014, 5, 10005
7219362 CIFC27 H19 F N2 O2P -18.0072; 10.1043; 13.211
100.264; 90.006; 93.327		1049.93Hosamani, Kallappa. M.; Reddy, Dinesh S.; Devarajegowda, Hirihalli. C.
Microwave-assisted synthesis of new fluorinated coumarin‒pyrimidine hybrids as potent anticancer agents, their DNA cleavage and X-ray crystal studies
RSC Adv., 2015, 5, 11261
7219363 CIFC27 H19 F N2 O3P -18.133; 10.2945; 12.7544
101.192; 90.344; 95.499		1042.4Hosamani, Kallappa. M.; Reddy, Dinesh S.; Devarajegowda, Hirihalli. C.
Microwave-assisted synthesis of new fluorinated coumarin‒pyrimidine hybrids as potent anticancer agents, their DNA cleavage and X-ray crystal studies
RSC Adv., 2015, 5, 11261
7219435 CIFC25 H22 N2 O S2P 21 21 217.2652; 8.0985; 35.69
90; 90; 90		2099.9Wei, Ruo-Hong; Chen, Jun-Feng; Feng, Jia-Qi; Hu, Jiong-Sheng; Cao, Deng-Ke
Two heteroleptic Ir(iii)‒bisthienylethene compounds: syntheses, structures and aggregation-induced luminescence
RSC Adv., 2015, 5, 14359
7219436 CIFC49 H41 F4 Ir N4 O3 S2P -110.8322; 11.8007; 18.99
75.86; 73.658; 83.633		2256.5Wei, Ruo-Hong; Chen, Jun-Feng; Feng, Jia-Qi; Hu, Jiong-Sheng; Cao, Deng-Ke
Two heteroleptic Ir(iii)‒bisthienylethene compounds: syntheses, structures and aggregation-induced luminescence
RSC Adv., 2015, 5, 14359
7219437 CIFC48 H41 Ir N4 O2 S2P -111.8712; 12.7429; 15.5387
98.555; 102.678; 111.645		2062.05Wei, Ruo-Hong; Chen, Jun-Feng; Feng, Jia-Qi; Hu, Jiong-Sheng; Cao, Deng-Ke
Two heteroleptic Ir(iii)‒bisthienylethene compounds: syntheses, structures and aggregation-induced luminescence
RSC Adv., 2015, 5, 14359
7219485 CIFC8 H17 Cl4 N3 O4 SnI m a 213.9718; 9.84; 11.9523
90; 90; 90		1643.23Arjmand, Farukh; Yousuf, Imtiyaz; Zaidi, Yusra; Toupet, Loic
Crystal structure determination, spectroscopic characterization and biological profile of a tailored ionic molecular entity, Sn(iv) iminodiacetic acid‒piperazinediium conjugate: in vitro DNA/RNA binding studies, Topo I inhibition activity, cytotoxic and systemic toxicity studies
RSC Adv., 2015, 5, 16250
7219490 CIFC29 H26 Cl3 N3 O5 SP -110.0614; 10.2208; 15.2649
104.231; 95.071; 109.24		1411.79Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219491 CIFC22 H20 N2 O4 SP 1 21/n 110.5141; 17.9454; 11.0976
90; 113.865; 90		1914.9Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219492 CIFC24 H20 F5 N3 O5 SP 1 21/n 17.907; 14.2862; 20.6839
90; 101.016; 90		2293.4Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219493 CIFC25.5 H21 Cl N4 O4 SP 1 21/c 16.2586; 43.8481; 17.0987
90; 93.143; 90		4685.3Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219494 CIFC26 H26 N2 O6 SP 1 21/n 116.084; 8.84163; 18.0999
90; 106.205; 90		2471.69Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219495 CIFC33 H25 N7 O6 SP 1 21/c 113.1236; 20.8432; 12.0391
90; 100.991; 90		3232.74Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219496 CIFC32 H34 Br2 N4 O6 SP -110.0627; 12.5064; 13.7858
87.321; 78.605; 70.03		1598.1Cowell, Joseph; Abualnaja, Matokah; Morton, Stephanie; Linder, Ruth; Buckingham, Faye; Waddell, Paul G.; Probert, Michael R.; Hall, Michael J.
Diastereoselective synthesis of functionalised carbazoles via a sequential Diels‒Alder/ene reaction strategy
RSC Adv., 2015, 5, 16125
7219520 CIFC11 H6 Ag N O4P -16.6702; 8.7729; 9.1647
78.49; 72.67; 68.92		475.1Song, Yang; Fan, Rui-Qing; Zhang, Hui-Jie; Liu, Zhi-Wei; Wang, Xue-Tao; Tan, Cai-Tu; Yang, Yu-Lin; Wang, Yu-Lei
Luminescent properties of Ag(i)/Cu(i) coordination polymers: crystal structures and high intensity luminescence of a PMMA-doped hybrid material based on a quinoline-2,3-dicarboxylic acid ligand
RSC Adv., 2015, 5, 17343
7219521 CIFC10 H7 Cu I N O2P 1 21/n 14.249; 15.962; 15.297
90; 90.03; 90		1037.5Song, Yang; Fan, Rui-Qing; Zhang, Hui-Jie; Liu, Zhi-Wei; Wang, Xue-Tao; Tan, Cai-Tu; Yang, Yu-Lin; Wang, Yu-Lei
Luminescent properties of Ag(i)/Cu(i) coordination polymers: crystal structures and high intensity luminescence of a PMMA-doped hybrid material based on a quinoline-2,3-dicarboxylic acid ligand
RSC Adv., 2015, 5, 17343
7219527 CIFC28 H30 N2 O3 P2P 1 21/n 19.6969; 12.8371; 10.8482
90; 111.738; 90		1254.36Gholivand, K.; Gholami, A.; Ebrahimi, A. A. V.; Abolghasemi, S. T.; Esrafili, M. D.; Fadaei, F. T.; Schenk, K. J.
Triphenyltin(iv) adducts of diphosphoryl ligands: structural, electronic and energy aspects from X-ray crystallography and theoretical calculations
RSC Adv., 2015, 5, 17482
7219528 CIFC66 H54 Cl2 O8 P2 Sn2P 1 21/c 116.9373; 9.79356; 18.195
90; 105.673; 90		2905.91Gholivand, K.; Gholami, A.; Ebrahimi, A. A. V.; Abolghasemi, S. T.; Esrafili, M. D.; Fadaei, F. T.; Schenk, K. J.
Triphenyltin(iv) adducts of diphosphoryl ligands: structural, electronic and energy aspects from X-ray crystallography and theoretical calculations
RSC Adv., 2015, 5, 17482
7219529 CIFC66 H55 Cl2 N O3 P2 Sn2P 1 21/n 118.1178; 9.15; 18.8435
90; 114.138; 90		2850.7Gholivand, K.; Gholami, A.; Ebrahimi, A. A. V.; Abolghasemi, S. T.; Esrafili, M. D.; Fadaei, F. T.; Schenk, K. J.
Triphenyltin(iv) adducts of diphosphoryl ligands: structural, electronic and energy aspects from X-ray crystallography and theoretical calculations
RSC Adv., 2015, 5, 17482
7219530 CIFC68 H62 Cl2 N4 O4 P2 Sn2P 1 2/c 120.193; 9.5523; 16.433
90; 104.235; 90		3072.4Gholivand, K.; Gholami, A.; Ebrahimi, A. A. V.; Abolghasemi, S. T.; Esrafili, M. D.; Fadaei, F. T.; Schenk, K. J.
Triphenyltin(iv) adducts of diphosphoryl ligands: structural, electronic and energy aspects from X-ray crystallography and theoretical calculations
RSC Adv., 2015, 5, 17482

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