Crystallography Open Database

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8106173 CIFC16 H17 N O2P 21 21 216.3761; 12.0521; 17.3288
90; 90; 90
1331.64Zhang, Mao-Yuan; Shi, Da-Bin
Crystal structure of methyl 4′-amino-3′,5′-dimethyl-[1,1′-biphenyl]-4-carboxylate, C16H17NO2
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 431-433
8106175 CIFC34 H56 O6P 21 21 218.0343; 17.7992; 24.153
90; 90; 90
3454Hongzhang, Liu; Yingting, Wang
The crystal structure of (3S,12R,20R,24S)-3,12-diacetyl-20,24-epoxy-dammarane-3,12,25-triol acetone solvate, C34H56O6
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 437-439
8106187 CIFC21 H22 N Na O11 SP 21 21 218.0489; 10.6418; 24.485
90; 90; 90
2097.26Chen, Hai-Lin; Pan, Li-Wei; Zhang, Hui-Ying; Yin, Xiu-Ju
Synthesis and crystal structure of poly[aqua{μ3-(1S,2S)-1-((7-hydroxy-3-(4-hydroxy-3-sulfonatophenyl)-4-oxo-4H-chromen-8-yl)methyl)pyrrolidin-1-ium-2-carboxylato-κ4 O,O′:O′′:O′′′}sodium(I)] monohydrate, C21H22NNaO11S
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 469-471
8106266 CIFC17 H14 N6 SP 21 21 217.3832; 14.4702; 15.2806
90; 90; 90
1632.52Aouad, Mohamed Reda; Messali, Mouslim; Rezki, Nadjet; Shivalingegowda, Naveen; Warad, Ismail
Crystal structure of 4-phenyl-3-((4-phenyl-1H-1,2,3-triazol-1-yl)methyl)-1H-1,2,4-triazole-5(4H)-thione, C17H14N6S
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 697-698
8106269 CIFC17 H20 Cl N O3 SP 21 21 216.1984; 14.394; 18.9651
90; 90; 90
1692.06Zhao, Li-Xia; Wang, Qing-Rui; Zou, Yue-Li; Wu, Hao; Ye, Fei
Crystal structure of methyl (R)-4-(o-chlorobenzoyl)-1-thia-4-azaspiro[4.5]decane-3-carboxylate, C17H20ClNO3S
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 709-710
8106301 CIFC25 H18 Mn N4 O4P 21 21 217.9366; 10.2389; 26.313
90; 90; 90
2138.2Yan, Lingling; Yang, Peng; Zhi, Guanghui
Crystal structure of hexaaqua-{(E)-N′-(1-(pyrazin-2-yl)ethylidene)isonicotinohydrazide-κ3 N,N′,O}praseodym(III) trichloride monohydrate, C12H25Cl3N5O8Pr
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 803-804
8106308 CIFC16 H14 N2P 21 21 216.449; 10.548; 17.84
90; 90; 90
1214Jia, Guo-Kai; Chen, Xiao-Ming; He, Fu-Lin; Chen, Xiu-Wen; Wang, Zong-Cheng
Crystal structure of 2-(3,4-dimethylphenyl)-1,8-naphthyridine, C16H14N2
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 819-820
8106311 CIFC20 H26 O5P 21 21 217.302; 11.307; 20.414
90; 90; 90
1685.5Zou, Juan; Zhao, Chen-Liang; Ye, Jiang-Hai; He, Kang; Tang, Ren-Tao; Pan, Lu-Tai
Crystal structure of 7β,9β-dihydroxy-15-oxo-ent-kauran-16-en-19,6β-olide, C20H26O5
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 825-826
8106348 CIFC26 H41 N O5P 21 21 219.6178; 13.3335; 19.0758
90; 90; 90
2446.3Liang, Yan; Fu, Yun-Xing; Liang, Jian-Ping
Crystal structure of (3aR,4R,5R,7R,8S,9R,9aS,12R)-7-ethyl-5-(1-hydroxy-2-((R)-3-hydroxypyrrolidin-1-yl)ethoxy)-4,7,9,12-tetramethyldecahydro-4,9a-propanocyclopenta[8]annulene-3,8-diol – a pleuromutilin derivative, C26H41NO5
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 923-925
8106361 CIFC16 H22 Br N O10P 21 21 219.7453; 9.9023; 21.885
90; 90; 90
2111.9Lin, Ping; Nie, Xu-Liang; Yin, Zhong-Ping; Li, Zhong-Chao; Liu, Jia; Shang-Guan, Xin-Chen; Peng, Da-Yong
Crystal structure of 6-(2-bromoacetamido)tetrahydro-2H-pyran-2,3,4,5-Tetrayl tetraacetate, C16H22BrNO10
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 955-957
8106384 CIFC10 H9 N3 O2P 21 21 214.3976; 10.8753; 19.678
90; 90; 90
941.1Sheng, Liang-Quan
Crystal structure of 2-(4-(4H-1,2,4-triazol-4-yl)phenyl)acetic acid, C10H9N3O4
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 1021-1022
8106397 CIFC24 H41 N OP 21 21 216.3752; 12.607; 26.943
90; 90; 90
2165.5Huo, Shao-Jie; Wu, Ji-Chun; He, Xi-Chen; Wu, Qi-Yun; Du, Jiang
Crystal structure of 3β-methoxy-20α-dimethylamino-pregn-5-ene, C24H41NO
Zeitschrift für Kristallographie - New Crystal Structures, 2018, 233, 1057-1058
8106415 CIFC22 H20 O5P 21 21 216.2039; 13.1634; 22.8258
90; 90; 90
1864.06Brito, Iván; Simirgiotis, Mario; Muñoz, Rubén; Benites, Julio; Pasten, Leyla; Bórquez, Jorge; Cárdenas, Alejandro
Crystal structure of 11-(p-coumaroyloxy)-tremetone, C22H20O5
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 13-14
8106420 CIFC20 H24 O6P 21 21 217.697; 13.91; 16.75
90; 90; 90
1793Zhao, Neng-Wu; Ye, Jiang-Hai; Zhao, Chen-Liang; Zhang, Jing-Jie; Pan, Lu-Tai
Crystal constructure of 16(S)-methyl-6α-carboxy-1, 15-dioxo-6, 7-seco-ent-kaur-2-en-7, 20-olide, C20H24O6
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 27-28
8106422 CIFC9 H11 Br N2 SP 21 21 217.5187; 8.0634; 17.532
90; 90; 90
1062.9El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Hayal Alotaibi, Mohammad; Kariuki, Benson M.
Crystal structure of 3-(2-bromophenyl)-1,1-dimethylthiourea, C9H11BrN2S
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 31-32
8106426 CIFC21 H24 N2 O3P 21 21 219.7186; 13.4479; 13.6679
90; 90; 90
1786.3Qiu, Rui-Xia; Li, Guo-Qiang; Chen, Hong-Ji; Wang, Lin; Wang, Chun-Hua
Crystal structure of methyl 2b-ethyl-1a,2a,2b,2b1,3,5,10,11-octahydro-1H-oxireno[2′,3′:6,7]indolizino[8,1-cd]carbazole-4-carboxylate, C21H24N2O3
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 43-45
8106447 CIFC24 H25 Cl N2 O2P 21 21 215.9066; 15.7928; 21.7829
90; 90; 90
2031.95Alshammari, Mohammed B.; Smith, Keith; Hegazy, Amany S.; Kariuki, Benson M.; El-Hiti, Gamal A.
Crystal structure of 3-(2-(4-chlorophenyl)-3-hydroxy-3,3-diphenylpropyl)-1,1-dimethylurea, C24H25ClN2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 101-103
8106468 CIFC10 H18 Cl4 Co N2 OP 21 21 217.0057; 7.4317; 29.251
90; 90; 90
1522.93Reiss, Guido J.; Sergeeva, Alena
The crystal structure of 3-((1R,2S)-1-methylpyrrolidin-1-ium-2-yl)pyridin-1-ium tetrachloridocobaltate(II) monohydrate, C10H18Cl4CoN2O
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 159-161
8106481 CIFC14 H14 N2 O2P 21 21 215.6736; 7.7803; 28.7821
90; 90; 90
1270.51Smaail, Radi; Tighadouini, Said; Eddike, Driss; Tillard, Monique; Mabkhot, Yahia N.
Crystal structure of (Z)-1-(1,5-dimethyl-1H-pyrazol-3-yl)-3-hydroxy-3-phenylprop-2-en-1-one, C14H14N2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 201-202
8106494 CIFC16 H12 Cl2 N2 O2P 21 21 216.0741; 14.9623; 16.2178
90; 90; 90
1473.91He, Jing
Crystal structure of 2-amino-4-(2,3-dichlorophenyl)-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile, C16H12Cl2N2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 237-238
8106542 CIFC15 H24 O3P 21 21 217.5352; 10.6639; 17.5406
90; 90; 90
1409.47Morales, Glauco; Paredes, Adrián; Brito, Iván; Cárdenas, Alejandro
Crystal structure of 1α,11-dihydroxyeremophil-9-en-8-one, C15H24O3
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 379-381
8106578 CIFC20 H24 O4P 21 21 218.3007; 12.0111; 17.0604
90; 90; 90
1700.93Yousaf, Muhammad; Nur-e-Alam, Mohammad; Ghabbour, Hazem A.; Al-Oqai, Mai; Al-Rehaily, Adnan J.
Crystal structure of (16S)-12,16-epoxy-11,14-dihydroxy-17(15/16)-abeo-3a,18-cyclo-8,11,13-abietatrien-7-one, C20H24O4
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 483-484
8106588 CIFC10 H16P 21 21 214.4804; 11.7784; 16.7613
90; 90; 90
884.53Benda, Christian; Klein, Wilhelm; Fässler, Thomas F.
Crystal structure of 1,2,3,4,5-pentamethyl-1,3-cyclopentadiene, C10H16
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 511-512
8106606 CIFC33 H41 N3 O2P 21 21 218.44861; 17.00722; 20.1555
90; 90; 90
2896.09Xu, Juan; Li, Peng; Wang, Hui P.; Ning, Li F.
Crystal structure of 11-(4-(dimethylamino)phenyl)-17-hydroxy-13-methyl-17-(prop-1-yn-1-yl)-1,2,6,7,8,11,12,13,14,15,16,17-dodecahydro-3H-cyclopenta[a]phenanthren-3-one – acetonitril (1/2), C33H41N3O2
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 573-575
8106643 CIFC4 H10 N4 O2P 21 21 215.4922; 7.4024; 17.5083
90; 90; 90
711.81Matulková, Irena; Charvátová, Hana; Císařová, Ivana; Štěpnička, Petr
The crystal structure of the inner salt of 2-[(aminoiminomethyl)amino]ethylcarbamic acid [systematic name: (2-((diaminomethylene)ammonio)ethyl)carbamate], C4H10N4O2
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 685-687
8106664 CIFC25 H18 Mn N4 O4P 21 21 217.9366; 10.2389; 26.313
90; 90; 90
2138.2Yin, Wei-Dong; Li, Gui-Lian
Crystal structure of poly[μ4-(4-(carboxylatomethyl)benzoato-κ4 O:O′:O′′:O′′′)-(2-(4-(1H-imidazol-1-yl)phenyl)-1H-benzo[d]imidazole-κN)manganese(II)] [Mn(C9H6O4)(C16H12N4)]
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 749-751
8106680 CIFC12 H18 N2 O4P 21 21 217.1591; 10.236; 16.713
90; 90; 90
1224.7Ye, Fei; Li, Juan-Juan; Xu, Zhao-Zheng; Fu, Ying
Crystal structure of 2-(8a-methyl-5-oxo-hexahydroimidazo [1,2-a]pyridin-1(5H)-yl)-2-oxoethyl acetate, C12H18N2O4
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 791-793
8106685 CIFC20 H22 Cd F4 N4 O6P 21 21 217.475; 12.246; 24.615
90; 90; 90
2253.2Hou-Qun, Yuan; Wen-Min, Wang; Chang-Gan, Huang; Wei, Xiao; Guang-Ming, Bao
Crystal structure of catena-poly[aqua-(μ 2-hexamethylenetetramine-κ 2 N:N′)-bis(2,6-difluorobenzoato-κ 2 O:O′)cadmium(II)]monohydrate, C20H22CdF4N4O6
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 807-809
8106693 CIFC24 H25 N O3 P RhP 21 21 219.5498; 13.4996; 17.428
90; 90; 90
2246.8Elmakki, Mohammed A.; Alexander, Orbett T.; Venter, Gertruida J. S.; Venter, Johan A.
The crystal structure of carbonyl(2-oxopyridin-1(2H)-olato-κ 2 O,O′)-(diphenylcyclohexylphosphine-κ P)rhodium(I), C24H25NO3PRh
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 831-833
8106715 CIFC30 H25 Cl2 N O2 P RhP 21 21 217.6656; 16.6097; 20.9423
90; 90; 90
2666.4Venter, Gertruida J.S.
The crystal structure of carbonyl-[4-(2,4-dichlorophenylamino)pent-3-en-2-onato-κ2 N,O]-(triphenylphosphine-κP)rhodium(I), RhC30H25Cl2NO2P
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 901-903
8106738 CIFC11 H12 O4P 21 21 219.922; 9.96; 10.967
90; 90; 90
1083.8Zhang, Yun-Peng; Li, Bing
The crystal structure of (S)-2-benzylsuccinic acid, C11H12O4
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 975-976
8106754 CIFC23 H31 N3 O2P 21 21 218.6213; 18.2577; 25.6873
90; 90; 90
4043.31Xing-An, Cheng; Zhan-Mei, Liu; Wei-Xin, Liang; Bo, Wu; Xu-Hong, Jiang
The crystal structure of the Matrine derivative: 12-(1H-indol-1-yl)dodecahydro-1H,5H,10H-dipyrido[2,1-f:3′,2′,1′-ij][1,6]naphthyridin-10-one hydrate, C23H29N3O
Zeitschrift für Kristallographie - New Crystal Structures, 2017, 232, 1017-1019
8106773 CIFC27 H23 N O3 SnP 21 21 218.9287; 15.0252; 18.4531
90; 90; 90
2475.6Wang, Qi-Bao; Ding, Rui-Fang; Sun, Shan-Shan; Ding, Lin
Crystal structure of catena-poly[(μ2-acetamido-benzoato-κ2 O:O′)triphenyltin(IV)], C27H23NO3Sn
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 21-23
8106813 CIFC16 H10 Cd N2 O4 SP 21 21 218.977; 11.751; 14.224
90; 90; 90
1500.5Yao, Li-Ping; Zhang, Li
Crystal structure of poly-[μ 2-4,4′-bipyridine-κ 2 N:N′−μ 3-thiophene-2,3-di-carboxylato-κ 4 O,O′, O′′:O′′′ -cadmium(II)]
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 161-163
8106856 CIFC19 H22 Cl N3 O SP 21 21 217.0418; 10.8802; 23.5506
90; 90; 90
1804.36Al-Alshaikh, Monirah A.; Ghabbour, Hazem A.; Al-Tamimi, Abdul-Malek S.; Abdelbaky, Mohammed S.M.; Garcia-Granda, Santiago; El-Emam, Ali A.
Crystal structure of 5-(adamantan-1-yl)-3-[(4-chloroanilino)methyl]-2,3-dihydro-1,3,4-oxadiazole-2-thione, C19H22ClN3OS
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 301-303
8106864 CIFC25 H30 Cl2 F3 N5 O6P 21 21 2111.0768; 15.662; 16.683
90; 90; 90
2894.25Barakat, Assem; Ghabbour, Hazem A.; Al-Majid, Abdullah Mohammed; Quah, Ching-Kheng; Fun, Hoong-Kun
Crystal structure of 5,5′-((4-(trifluoromethyl)phenyl)methylene)bis(1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione) – diethylamine – dichloromethane (1/1/1) C25H32Cl2F3N5O6
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 321-323
8106920 CIFC14 H10 Cl2 O2P 21 21 215.8499; 8.6822; 24.6389
90; 90; 90
1251.41Lizhen, Chen; Jianlong, Wang
The crystal structure of 1-(4-(4-chlorophenoxy)-2-chlorophenyl)ethanone, C14H10Cl2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 497-498
8106945 CIFC21 H34 O3P 21 21 217.542; 11.6929; 22.657
90; 90; 90
1998.1Brito, Iván; Bórquez, Jorge; Simirgiotis, Mario; Cárdenas, Alejandro; Molina-Salinas, Gloria M.; Jerz, Gerold; Peña-Rodriguez, Luis Manuel; Winterhalter, Peter
Crystal structure of methyl 8-hydroxy-3-isopropyl-5a,8-dimethyl-2,3,4,5,5a,6,7,8,10a,10b-decahydrocyclohepta[e]indene-3a(1H)-carboxylate, C21H34O3
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 579-582
8106968 CIFC16 H17 N O3P 21 21 217.9882; 11.4053; 16.2381
90; 90; 90
1479.42Mierina, Inese; Gudelis, Emilis; Stepanovs, Dmitrijs; Jure, Mara; Mishnev, Anatoly; Kolympadi, Maria; Marković, Dean
Crystal structure of 3-(4-hydroxy-3-methoxyphenyl)-N-phenylpropanamide, C16H17NO3
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 657-659
8106993 CIFC20 H34 O4P 21 21 216.222; 13.705; 21.903
90; 90; 90
1867.7Zhao, Chen-Liang; Zhang, Jing-Jie; Zhang, Qi-Long; Pan, Lu-Tai
Crystal structure of 5,5,9,13-tetramethyltetracyclo[10·2·1·01,10·04,9]pentadecane-3,7,14-triol, C20H34O4
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 745-746
8107009 CIFC18 H25 Br2 N3 PdP 21 21 219.8678; 13.874; 14.7557
90; 90; 90
2020.14Li, Guo-Xing
Crystal structure of (1-((1-benzylpyrrolidin-2-yl-κN)methyl)-3-isopropyl-1H-imidazol-2(3H)-ylidene–κC)dibromidopalladium(II), C18H25Br2N3Pd
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 795-796
8107011 CIFC17 H23 Cl2 N3 PdP 21 21 219.646; 13.883; 14.52
90; 90; 90
1944.5Qian, Peng-Cheng
Crystal structure of ((1-((1-benzylpyrrolidin-2-yl)methyl)-3-ethyl-1H-imidazol-2(3H)-ylidene)-κ2 C,N)dichloridopalladium(II), C17H23Cl2N3Pd
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 799-800
8107014 CIFC11 H14 N2 O2P 21 21 217.5411; 11.5148; 12.537
90; 90; 90
1088.64El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Alanazi, Saud A.; Kariuki, Benson M.
Crystal structure of 3-tert-butyl-3-hydroxy-1,3-dihydro-2H-pyrrolo[3,2-c]pyridin-2-one, C11H14N2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 809-810
8107026 CIFC19 H20 N2 O5P 21 21 2110.392; 10.7709; 14.881
90; 90; 90
1665.6Barakat, Assem; Al-Majid, Abdullah Mohammed; Ali, M.; Ghabbour, Hazem A.; Al-Marashdah, M.S.; Siddiqui, Mohammed Rafiq
Crystal structure of 6-hydroxy-5-((2-hydroxy-6-oxocyclohex-1-en-1-yl)(phenyl)methyl)-1,3-dimethylpyrimidine-2,4(1H,3H)-dione, C19H20N2O5
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 849-851
8107039 CIFC22 H30 O6P 21 21 215.979; 16.735; 20.323
90; 90; 90
2033Liu, Ya-Hua; Zhang, Jing-Jie; Ye, Jiang-Hai; Zhao, Chen-Liang; Pan, Lu-Tai
Crystal structure of 1α,7β-dihydroxy-11β-acetoxy-ent-7β,20-epoxykaur-16-en-15-one, C22H30O6
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 891-892
8107041 CIFC20 H28 O5P 21 21 218.435; 11.693; 18.015
90; 90; 90
1776.8Xin, Lai-Xiang; Zhang, Jing-Jie; Ye, Jiang-Hai; Zhao, Chen-Liang; Pan, Lu-Tai
Crystal structure of ent-1β,7α,11α-trihydroxy-7β,20-epoxykaur-16-en-15-one, C20H28O5
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 895-896
8107100 CIFC11 H14 N2 O2P 21 21 217.3227; 10.9955; 26.3709
90; 90; 90
2123.3El-Hiti, Gamal A.; Smith, Keith; Hegazy, Amany S.; Masmali, Ali M.; Kariuki, Benson M.
Crystal structure of 3-tert-butyl-7-azadioxindole, C11H14N2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1069-1070
8107140 CIFC16 H12 N2 OP 21 21 215.4475; 12.2779; 18.0975
90; 90; 90
1210.43Amr, Abd El-Galil E.; Hafez, Naglaa A. Abdel; Ali, Korany A.; Al-Omar, Mohamed A.; Ghabbour, Hazem A.
Crystal structure of 1,4-dihydro-1-phenylchromeno[4,3-c]pyrazole, C16H12N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2016, 231, 1185-1187
8107167 CIFC8 H6 N8 O8P 21 21 216.7563; 7.2512; 25.884
90; 90; 90
1268.1Yong, Wang; Bingheng, Wu; Jun, Yuan; Duanlin, Cao; Jianlong, Wang; Lizhen, Chen
Crystal structure of 1,2-bis(4,5-dinitro-1H-imidazol-1-yl)ethane, C8H6N8O8
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 611-612
8107170 CIFC22 H27 Cl N2 O3P 21 21 218.6797; 9.8809; 24.7824
90; 90; 90
2125.42Zhang, Jingxiao; Gu, Miao; Bai, Xinyu
The crystal structure of (1S,3R)-1-(4-isopropylphenyl)-3-(methoxycarbonyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-iumchloride monohydrate, C22H27ClN2O3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 619-621
8107192 CIFC36 H26 Mn N4 O5P 21 21 2110.7134; 10.7573; 26.6304
90; 90; 90
3069.1Hua-Xiang, Zhang; Xi-Shi, Tai
The crystal structure of [(1,10-phenantroline-κ2 N,N′)-bis(6-phenylpyridine-2-carboxylato-κ2 N,O)manganese(II)] monohydrate, C36H26N4O5Mn
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 697-699
8107202 CIFC21 H22 N Na O12 SP 21 21 217.685; 10.803; 25.9262
90; 90; 90
2152.42Chen, Hai-Lin; Huang, Xiu-Xiang; Lan, Jian-Jing; Yao, Dong-Mei; Wang, Yan-Ping; Liu, Qiu-Ping
Synthesis and crystal structure of poly[aqua(μ4-(1R,2S,4R)-4-hydroxy-1-((7-hydroxy-3-(4-hydroxy-3-sulfonatophenyl)-4-oxo-4H-chromen-8-yl)methyl)pyrrolidin-1-ium-2-carboxylate-κ4 O:O′:O″:O‴)sodium(I)] monohydrate, C21H22NNaO12S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 733-735
8107224 CIFC27 H39 N OP 21 21 2110.5248; 12.6248; 16.8913
90; 90; 90
2244.4Zhang, Wen-Wen; Ye, Jiang-Hai; Zou, Juan; He, Kang
Synthesis and crystal structure of 1-((3R,10S,13R,17S)-10,13-dimethyl-3- (phenylamino)hexadecahydro-1H-cyclopenta[α] phenanthren-17-yl)ethan-1-one, C27H39NO
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 815-817
8107254 CIFC5 H5 N9 O6P 21 21 215.6068; 10.0191; 18.3799
90; 90; 90
1032.49Huipeng, Zhao; Pengbao, Lian; Yumin, Yan; Lizhen, Chen; Jianlong, Wang
The crystal structure of 3-amino-1,2,4-triazolium 2,4,5-trinitroimidazolate, C5H5O6N9
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 927-928
8107302 CIFC14 H10 I N3P 21 21 218.0778; 11.1909; 14.3114
90; 90; 90
1293.72Caracelli, Ignez; Teixeira, Wystan K. O.; de Albuquerque, Danilo Yano; Schwab, Ricardo S.; Tiekink, Edward R. T.
The crystal structure of 1-(2-iodophenyl)-4-phenyl-1H-1,2,3-triazole, C14H10IN3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1093-1096
8107316 CIFC20 H19 N3 OP 21 21 215.8776; 7.6503; 36.447
90; 90; 90
1638.9Jin, Kun-Sheng; Wu, Wei-Na
Crystal structure of (E)-N-(4-morpholinophenyl)-1-(quinolin-2-yl)methanimine, C20H19N3O
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1137-1138
8107323 CIFC15 H15 Fe2 N O10 SP 21 21 2110.801; 13.24; 15.545
90; 90; 90
2223Xia, Yu-Pei
Crystal structure of bis(tricarbonyl)-{(S)-(tert-butoxycarbonyl)(1-methoxy-1-oxo-3-sulfido-k2 S:S′-propan-2-yl)amido-k2N:N′}diiron(I) (Fe—Fe), C15H15Fe2NO10S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1161-1162
8107324 CIFC11 H11 Cl O2 SP 21 21 215.7516; 7.4097; 27.461
90; 90; 90
1170.3Yuan, Fei; Guo, Ya-Fei; Ma, Jun-Ying; Guo, Ke-Wen; Xu, Zhi-Cong
Crystal structure of (E)-3-((4-chlorophenyl)thio)-4-hydroxypent-3-en-2-one, C11H11ClO2S
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1163-1165
8107329 CIFC26 H31 Br N2 O3P 21 21 2111.01; 13.227; 16.458
90; 90; 90
2397Zhen, Chen; Yanwen, Sun; Yingying, Meng
The crystal structure of tert-butyl 2-(4-(12-bromo [2.2]paracyclophanyl)carbamoyl)pyrrolidine-1-carboxylate, C26H31BrN2O3
Zeitschrift für Kristallographie - New Crystal Structures, 2022, 237, 1185-1187
8107344 CIFC28 H41 N OP 21 21 2110.5758; 12.3659; 18.0301
90; 90; 90
2358Huang, Hua; Zhang, Wen-Wen; Ye, Jiang-Hai; Zou, Juan; He, Kang
Synthesis and crystal structure of 1-((3R,10S,13R,17S)-10,13-dimethyl-3-(p-tolylamino)hexadecahydro-1H-cyclopenta-[a]phenanthren-17-yl)ethan-1-one, C28H41NO
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 31-33
8107357 CIFC26 H41 N O8P 21 21 218.2437; 13.1867; 22.849
90; 90; 90
2483.85Liu, Huan-Ni; Hao, Yi-Kun; Chen, Neng-Hua; Li, Lai-Ming
Crystal structure of 14-O-acetyldelcosine, C26H41NO8
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 75-77
8107390 CIFC16 H14 Cl2 O5P 21 21 2123.2297; 16.3509; 8.73
90; 90; 90
3315.89Zhang, Meng; Bai, Yu-Bin
The crystal structure of (2R,6′R)-2′,7-dichloro-4,6-dimethoxy-6′-methyl-3H-spiro[benzofuran-2,1′-cyclohexan]-2′-ene-3,4′-dione, C16H14Cl2O5
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 185-187
8107391 CIFC28 H41 N O2P 21 21 2110.448; 12.4188; 18.3905
90; 90; 90
2386.2Zhang, Wen-Wen; Ye, Jiang-Hai; Huang, Hua; Zou, Juan; He, Kang
Synthesis and crystal structure of 1-((3R,10S,13R,17S)-3-((4-methoxyphenyl)amino)-10,13-dimethylhexadecahydro-1H-cyclopenta[α]-phenanthren-17-yl)ethan-1-one, C28H41NO2
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 189-191
8107393 CIFC26 H44 O11P 21 21 2122.6816; 7.3911; 15.6072
90; 90; 90
2616.4Wang, Lei; Li, Guang-Jie; Ye, Jiang-Hai; He, Kang; Zou, Juan
Crystal structure of (−)-β-D-19-glucopiranosyl-9,15-dihydroxy kaurenoate, C26H40O9
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 197-199
8107419 CIFC22 H16 Cr F6 N6 PP 21 21 2111.3511; 12.135; 17.382
90; 90; 90
2394.3Zhuo, Linhai; Zhang, Jinjun
The crystal structure of cis-Dicyano-bis(2,2′-bipyridine)k2 N,N′-chromium(III) hexafluorophosphate, C22H16N6F6PCr
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 289-291
8107426 CIFC30 H40 O5P 21 21 216.5012; 15.3297; 26.8138
90; 90; 90
2672.3Ye, Jiang-Hai; Chen, Ren-Song; Xu, Chuan-Yan; Zou, Juan; Zhang, Jing-Jie
Crystal structure of (3a7R,13bR)-3-((1R)-1-hydroxy-1-(5-methyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)ethyl)-3a,11,11,13b-tetramethyl-2,3,3a,4,5,11,11a,12,13,13b-decahydroindeno[5′,4′:4,5] cyclohepta[1,2-c]oxepin-9(1H)-one, C30H40O5
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 313-315
8107431 CIFC30 H36 F2 N6 O9 SP 21 21 215.2364; 10.025; 59.689
90; 90; 90
3133.4Xia, Ying-Fan; Lu, Rong-Bin; Sun, Wei-Jie; Lin, Shu-Ting; Zhang, Jia-Rong; Jiang, Cheng-Jun
The crystal structure of 3,4-dihydroxybenzoic acid – 3-[7-{[2-(3,4-difluorophenyl)cyclopropyl]amino}-5-(propylsulfanyl)-3H-[1,2,3] triazolo[4,5-d]pyrimidin-3-yl]-5-(2-hydroxyethoxy)cyclopentane-1,2-diol – water (1/1/1), C30H36F2N6O9S
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 331-333
8107437 CIFC24 H30 O7P 21 21 2111.4194; 13.4657; 14.7549
90; 90; 90
2268.86Chen, Ren-Song; Ye, Jiang-Hai; Luo, Yu-Ling; Xu, Chuan-Yan; Zou, Juan; Zhang, Jing-Jie
Crystal structure of 1,2,3,5,13-pentamethoxy-6,7-dimethyl-1,2,3,4,4a,5,6,7,8,13b-decahydrobenzo[3′,4′]cycloocta[1′,2′:4,5]benzo[1,2-d][1,3]dioxole, C24H30O7
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 349-351
8107441 CIFC16 H13 N3 OP 21 21 217.6087; 9.6681; 18.66
90; 90; 90
1372.66Cui, Beibei; Mi, Xia; Zhang, Jingyu
Crystal structure of 2-(2-(4-methoxyphenyl)-2H-indazol-3-yl)acetonitrile, C16H13N3O
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 361-362
8107453 CIFC20 H30 N4 O3 SP 21 21 217.7152; 10.6132; 25.599
90; 90; 90
2096.12Al-Sanea, Mohammad M.; Abdelbaky, Mohammed S. M.; Garcia-Granda, Santiago; Mohamed, Ahmed A. B.; Tiekink, Edward R. T.; El-Emam, Ali A.
Crystal structure of ethyl 4-{[5-(adamantan-1-yl)-2-sulfanylidene-2,3-dihydro-1,3,4-oxadiazol-3-yl]methyl}piperazine-1-carboxylate, C20H30N4O3S
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 403-405
8107458 CIFC14 H11 Cl3 N2 OP 21 21 218.36; 12.0085; 14.3665
90; 90; 90
1442.27Li, Yingju; Yang, Zhimao
The crystal structure of 1-(2-chlorobenzyl)-3-(3,5-dichlorophenyl)urea, C14H11Cl3N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 421-423
8107482 CIFC20 H26 O5P 21 21 217.5455; 12.735; 18.333
90; 90; 90
1761.7Zhang, Lu; Yuan, Hang; Ye, Jiang-Hai; He, Kang; Lai, Chun-Hua; Zou, Juan
Crystal structure of 7α,11α-dihydroxy-15-oxo-ent-kauran-16-en-19,6β-olide, C20H26O5
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 513-515
8107491 CIFC14 H19 Cl N2 OP 21 21 218.9579; 12.2172; 12.5669
90; 90; 90
1375.33Li, Yuanci; Feng, Zhiqiang; Tong, Hongjuan
The crystal structure of 1-(2-chlorophenyl)-3-cycloheptylurea, C14H19ClN2O
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 547-549
8107539 CIFC18 H10 O2P 21 21 213.9566; 12.2859; 24.5014
90; 90; 90
1191.02Zheng, Xiaoxin; Jiang, Jinke; Liu, Yang
Crystal structure of tetracene-5,12-dione, C18H10O2
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 717-718
8107542 CIFC13 H18 N2 O4 SP 21 21 216.8619; 12.0735; 16.6591
90; 90; 90
1380.16Wang, Zhen; Zhao, Feng-Lan; Hou, Gui-Ge; Meng, Qing-Guo
Crystal structure of methyl ((4-aminobenzyl)sulfonyl)-L-prolinate, C13H18N2O4S
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 725-727
8107545 CIFC23 H34 O5P 21 21 2111.1838; 11.7824; 16.316
90; 90; 90
2149.99Li, Shi-Qing; Zhou, Jian; Dong, Zhang-Chao; Pan, Bo Wen; Shi, Yang; Zhou, Ying
Synthesis and crystal structure of (S,E)-4-hydroxy-3-(2-((4aR,6aS,7R,10aS,10bR)-3,3,6a,10b-tetramethyl-8-methylenedecahydro-1H-naphtho[2,1-d][1,3]dioxin-7-yl)ethylidene)dihydrofuran-2(3H)-one, C23H34O5
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 735-737
8107563 CIFC36 H36 N2 OP 21 21 2111.849; 14.373; 17.183
90; 90; 90
2926.4Chen, Zhen; Sun, Yanwen; Chen, Chao; Xu, Nuo; Wang, Xiaozhong; Li, Sijun
The crystal structure of (S, R p )-4–benzhydrylideneamino-12-(4-tert-butyl oxazolin-2-yl)[2.2]paracyclophane, C36H36N2O
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 791-793
8107582 CIFC16 H12 F3 N OP 21 21 216.9928; 8.9764; 21.216
90; 90; 90
1331.7Pu, Xuewei; Meng, Fanjie; Zhang, Shaoliang
The crystal structure of [1-(4-(trifluoromethyl)phenyl)-3,4-dihydroquinolin-2(1H)-one], C16H12F3NO
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 857-859
8107584 CIFC10 H9 Br N2P 21 21 215.907; 9.2731; 17.5641
90; 90; 90
962.09Kočović, David; Mugoša, Snežana; Shova, Sergiu; Tomić, Zoran D.; Jaćimović, Željko K.
Crystal structure of 3-(4-bromophenyl)-5-methyl-1H-pyrazole, C10H9BrN2
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 863-865
8107606 CIFC28 H36 F N O2P 21 21 216.3277; 11.9665; 32.2419
90; 90; 90
2441.4Yue, Lan; Wei, Peng; Ye, Jiang-Hei; He, Kang; Zou, Juan
Synthesis and crystal structure of (3E,5S,10S,13S,14S,17Z)-17-ethylidene-10,13-dimethylhexadecahydro-3H-cyclopenta[α] phenanthren-3-one O-(4-fluorobenzoyl) oxime, C28H36FNO2
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 941-943
8107613 CIFC63 H94 B2 Ge N8P 21 21 2117.175; 19.1188; 19.4359
90; 90; 90
6382.1Wang, Bing; Hu, Yi-Fei; Wu, Di
Crystal structure of 1,3-diisopropyl-4,5-dimethylimidazol-2-ylidene-N,N′-bis(1,3-bis(2,6-diisopropylphenyl)-1,3-dihydro-2H-1,3,2-diazaborol-2-yl)-l 2-germenediamine, C63H94B2GeN8
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 965-968
8107623 CIFC11 H19 N7 O9P 21 21 216.2578; 15.4188; 17.6841
90; 90; 90
1706.3Guannan, Zhao; Tong, Zhang; Jun, Chen; Hongxia, Pan; LiZhen, Chen; Jianlong, Wang
The crystal structure of the co-crystal 1,4-dioxane–4,6-bis(nitroimino)-1,3,5-triazinan-2-one(2/1), C11H19N7O9
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1001-1003
8107658 CIFC12 H14 Li N O5P 21 21 215.1481; 8.9342; 25.733
90; 90; 90
1183.57Yin, Dejing; Wang, Lingling; Yuan, Zhenbo
Crystal structure of poly[(μ-benzoato)-(μ-cis-4–hydroxy-D-proline)lithium], C12H14LiNO5
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1055-1056
8107681 CIFC12 H10 N4 O4 ZnP 21 21 217.6139; 12.489; 13.9382
90; 90; 90
1325.4Liu, Fang-Fang; Ping, Zhao-Yan; Zhou, Wei-Wei; Zhao, Wang
The crystal structure of poly[bis(μ 2−3−aminopyridine−4−carboxylato−κ 2 N:O)Zinc(II)], [Zn(C6H5N2O2)2] n
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1131-1132
8107703 CIFC16 H15 F N2 O2P 21 21 217.2516; 11.378; 17.1177
90; 90; 90
1412.36Wen, Juanjuan; Liu, Langlang; Tang, Wenqiang; Liu, Bin
The crystal structure of (E)-4-fluoro-N′-(1-(4-hydroxyphenyl)propylidene)benzohydrazide, C16H15FN2O2
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1205-1207
8107705 CIFC14 H10 Br N SP 21 21 215.6392; 7.793; 28.2476
90; 90; 90
1241.38Wang, Ning; Guo, Ya-Fei; Ma, Jun-Ying; Liu, Ming-Ming; Qu, Yu-Long
Crystal structure of 3-((4-bromophenyl)thio)-1H-indole, C14H10BrNS
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1211-1213
8107712 CIFC36 H52 F N O3P 21 21 217.8101; 13.1592; 30.5721
90; 90; 90
3142Liu, Zi-Yu; Wang, Wen-Shui; Jiang, Sheng; Zhao, Feng-Lan; Meng, Qing-Guo
Crystal structure of (5R,8R,9R,10R,12R,13R,14R, 17S,17Z)-2-((3-fluoropyridin-4-yl)methylene)-12-hydroxy-4,4,8,10,14-pentamethyl-17-((R)-2,6,6-trimethyltetrahydro-2H-pyran-2-yl)hexadecahydro-3H-cyclopenta[a]phenanthren-3-one, C36H52FNO3
Zeitschrift für Kristallographie - New Crystal Structures, 2023, 238, 1237-1239
8107715 CIFC8 H6 Br2 OP 21 21 214.0853; 9.6025; 21.989
90; 90; 90
862.61Hosten, Eric C.; Betz, Richard
Redetermination of the crystal structure of p-bromophenacyl bromide at 200 K – Localization of hydrogen atoms, C8H6Br2O
Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 59-60
8107717 CIFC19 H15 Br2 Cl OP 21 21 214.501; 16.229; 24.2
90; 90; 90
1767.7Li, Shi-Hui; Zhao, Yan; Zhang, Meng-Yin
Crystal structure of 3-bromo-4-(2-bromo-ethyl)-5-(4-chloro-phenyl)-2-ptolyl- furan, C19H15Br2ClO
Zeitschrift für Kristallographie - New Crystal Structures, 2015, 230, 63-64
9000041 CIFC4 Br N2 O4P 21 21 218.21; 18.42; 5.4
90; 90; 90
816.632Barney, E.
The structure of diglycine hydrobromide
American Mineralogist, 1947, 32, 685-685
9000249 CIFAs2 H4 Mn5 O12P 21 21 2118.29; 5.75; 9.31
90; 90; 90
979.109Moore, P. B.; Molin-Case J
Crystal chemistry of the basic manganese arsenates: V. Mixed manganese coordination in the atomic arrangement of arsenoclasite
American Mineralogist, 1971, 56, 1539-1552
9000252 CIFAg2 SeP 21 21 214.333; 7.062; 7.764
90; 90; 90
237.576Wiegers, G. A.
The crystal structure of the low-temperature form of silver selenide
American Mineralogist, 1971, 56, 1882-1888
9000514 CIFAl Ca H O5 SiP 21 21 217.055; 8.542; 5.683
90; 90; 90
342.479McNear, E.; Vincent, M. G.; Parthe, E.
The crystal structure of vuagnatite, CaAl(OH)SiO4
American Mineralogist, 1976, 61, 831-838
9001490 CIFCu H4 O5 SeP 21 21 216.674; 9.161; 7.398
90; 90; 90
452.318Robinson, P. D.; Sen Gupta, P. K.; Swihart, G. H.; Houk, L.
Crystal structure, H positions, and the Se lone pair of synthetic chalcomenite, Cu(H2O)2[SeO3]
American Mineralogist, 1992, 77, 834-838
9001875 CIFCa H Mn O5 SiP 21 21 215.837; 7.211; 8.693
90; 90; 90
365.894Nyfeler, D.; Hoffmann, C.; Armbruster, T.; Kunz, M.; Libowitzky, E.
Orthorhombic Jahn-Teller distortion and Si-OH in mozartite, CaMnO[SiO3OH]: A single-crystal X-ray, FTIR, and structure modeling study Sample: at T = 100 K
American Mineralogist, 1997, 82, 841-848
9001876 CIFCa H Mn O5 SiP 21 21 215.842; 7.228; 8.704
90; 90; 90
367.535Nyfeler, D.; Hoffmann, C.; Armbruster, T.; Kunz, M.; Libowitzky, E.
Orthorhombic Jahn-Teller distortion and Si-OH in mozartite, CaMnO[SiO3OH]: A single-crystal X-ray, FTIR, and structure modeling study Sample: at T = 300 K
American Mineralogist, 1997, 82, 841-848
9001877 CIFCa H Mn O5 SiP 21 21 215.846; 7.248; 8.726
90; 90; 90
369.736Nyfeler, D.; Hoffmann, C.; Armbruster, T.; Kunz, M.; Libowitzky, E.
Orthorhombic Jahn-Teller distortion and Si-OH in mozartite, CaMnO[SiO3OH]: A single-crystal X-ray, FTIR, and structure modeling study Sample: at T = 500 K
American Mineralogist, 1997, 82, 841-848
9002232 CIFC H15 Ca O19 U3P 21 21 2111.2706; 7.1055; 20.807
90; 90; 90
1666.29Burns, P. C.; Finch, R. J.
Wyartite: Crystallographic evidence for the first pentavalent-uranium mineral
American Mineralogist, 1999, 84, 1456-1460
9004061 CIFAs Ca Cu H O5P 21 21 217.4; 5.84; 9.21
90; 90; 90
398.019Qurashi, M. M.; Barnes, W. H.
The structures of the minerals of the descloizite and adelite groups: IV - descloizite and conichalcite (part 2) The structure of conichalcite
The Canadian Mineralogist, 1963, 7, 561-577
9004063 CIFH O5 Pb V ZnP 21 21 217.6; 6.07; 9.44
90; 90; 90
435.486Qurashi, M. M.; Barnes, W. H.
The structures of the minerals of the descloizite and adelite groups: V - descloizite and conichalcite (part 3). The structure of descloizite
The Canadian Mineralogist, 1964, 8, 23-39

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