file
int64
a
float64
siga
float64
b
float64
sigb
float64
c
float64
sigc
float64
alpha
float64
sigalpha
float64
beta
float64
sigbeta
float64
gamma
float64
siggamma
float64
vol
float64
sigvol
float64
celltemp
float64
sigcelltemp
float64
diffrtemp
float64
sigdiffrtemp
float64
cellpressure
float64
sigcellpressure
float64
diffrpressure
float64
sigdiffrpressure
float64
thermalhist
string
pressurehist
string
compoundsource
string
nel
string
sg
string
sgHall
string
sgNumber
int64
commonname
string
chemname
string
mineral
string
formula
string
calcformula
string
cellformula
string
Z
int64
Zprime
float64
acce_code
string
authors
string
title
string
journal
string
year
int64
volume
int64
issue
string
firstpage
string
lastpage
string
doi
string
method
string
radiation
string
wavelength
float64
radType
string
radSymbol
string
Rall
float64
Robs
float64
Rref
float64
wRall
float64
wRobs
float64
wRref
float64
RFsqd
float64
RI
float64
gofall
float64
gofobs
float64
gofgt
float64
gofref
float64
duplicateof
int64
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int64
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string
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int64
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string
cif_text
string
1,011,241
8.36
0.01
8.36
0.01
8.36
0.01
90
null
90
null
90
null
584.3
null
null
null
null
null
null
null
null
null
synthetic
3
F d -3 m :1
F 4d 2 3 -1d
227
Magnesium diiron(III) oxide
Magnesioferrite
- Fe2 Mg O4 -
- Fe2 Mg O4 -
- Fe16 Mg8 O32 -
8
0.041667
Barth, T F W; Posnjak, E
Spinel structures: with and without variate atom equipoints
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,932
82
325
341
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Barth, T F W; Posnjak, E Spinel structures: with and without variate atom equipoints Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 82 (1932) 325-341
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011241.cif $ #-------------------------------------------------------------------...
1,011,242
9.4
0.03
9.4
0.03
6.93
0.03
90
null
90
null
120
null
530.3
null
null
null
null
null
null
null
null
null
synthetic
4
P 63/m
-P 6c
176
Pentacalcium tris(phosphate) hydroxide
Hydroxylapatite
- Ca5 H O13 P3 -
- Ca5 H O13 P3 -
- Ca10 H2 O26 P6 -
2
0.166667
Hendricks, S B; Jefferson, M E; Mosley, V M
The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,932
81
352
369
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hendricks, S B; Jefferson, M E; Mosley, V M The Crystal Structures of Some Natural and Synthetic Apatite-Like Substances Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 81 (1932) 352-369
303,120
2025-10-31
16:25:08
#------------------------------------------------------------------------------ #$Date: 2025-10-31 18:24:25 +0200 (Fri, 31 Oct 2025) $ #$Revision: 303120 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011242.cif $ #-------------------------------------------------------------------...
1,011,243
10.44
null
10.44
null
10.44
null
90
null
90
null
90
null
1,137.9
null
null
null
null
null
null
null
null
null
synthetic
3
F d -3 m :1
F 4d 2 3 -1d
227
Lead diantimonate
Bindheimite
- O7 Pb2 Sb2 -
- O7 Pb2 Sb2 -
- O56 Pb16 Sb16 -
8
0.041667
Natta, G; Baccaredda, M
Tetrossido di antimonio e antimoniati
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,933
85
271
296
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Natta, G; Baccaredda, M Tetrossido di antimonio e antimoniati Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 85 (1933) 271-296
282,068
2023-03-26
10:11:44
#------------------------------------------------------------------------------ #$Date: 2023-03-26 11:09:57 +0300 (Sun, 26 Mar 2023) $ #$Revision: 282068 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011243.cif $ #-------------------------------------------------------------------...
1,011,244
9.1
null
9.1
null
9.1
null
90
null
90
null
90
null
753.6
null
null
null
null
null
null
null
null
null
from Niedermendig, Laacher See, Eifel, Germany
6
P -4 3 n
P -4n 2 3
218
Hexasodium dicalcium hexaaluminium hexasilicate disulfate *
Hauyne
- Al6 Ca2 Na6 O32 S2 Si6 -
- Al6 Ca2 Na6 O32 S2 Si6 -
- Al6 Ca2 Na6 O32 S2 Si6 -
1
0.041667
Machatschki, F
Kristallstruktur von Hauyn und Nosean
Zentralblatt fuer Mineralogie und Geologie, A
1,934
1,934
136
144
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Machatschki, F Kristallstruktur von Hauyn und Nosean Zentralblatt fuer Mineralogie und Geologie, A 1934 (1934) 136-144
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011244.cif $ #-------------------------------------------------------------------...
1,011,245
8.36
0.005
8.36
0.005
8.36
0.005
90
null
90
null
90
null
584.3
null
null
null
null
null
null
null
null
null
3
F d -3 m :1
F 4d 2 3 -1d
227
Magnesium diiron(III) oxide
Magnesioferrite
- Fe2 Mg O4 -
- Fe2 Mg O4 -
- Fe16 Mg8 O32 -
8
0.041667
Passerini, L
Ricerche sugli Spinelli.- II- I Composti. Cu Al2 O4, Mg Al2 O4 , Mg Fe2 O4, Zn Al2 O4, Zn Cr2 O4, Zn Fe2 O4, Mn Fe2 O4
Gazzetta Chimica Italiana
1,930
60
389
399
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Passerini, L Ricerche sugli Spinelli.- II- I Composti. Cu Al2 O4, Mg Al2 O4 , Mg Fe2 O4, Zn Al2 O4, Zn Cr2 O4, Zn Fe2 O4, Mn Fe2 O4 Gazzetta Chimica Italiana 60 (1930) 389-399
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011245.cif $ #-------------------------------------------------------------------...
7,015,180
8.1497
0.0007
9.4618
0.0011
17.913
0.0016
86.292
0.002
80.051
0.002
64.497
0.002
1,227.9
0.2
100
2
100
2
null
null
null
null
7
P -1
-P 1
2
work
- C26 H23 Au N3 O3 P S -
- C26 H23 Au N3 O3 P S -
- C52 H46 Au2 N6 O6 P2 S2 -
2
1
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.0574
0.0445
null
null
0.0839
0.0897
null
null
null
null
null
1.036
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
301,847
2025-08-21
11:39:33
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015180.cif $ #-------------------------------------------------------------------...
1,011,246
5.2
null
8.92
null
10.25
null
90
null
100
null
90
null
468.2
null
null
null
null
null
null
null
null
null
from Toller Graben, Elbingerode, Harz, Germany
4
C 1 m 1
C -2y
8
Aluminium silicate hydroxide *
Halloysite
- Al2 H8 O11 Si2 -
- Al2 H8 O11 Si2 -
- Al4 H16 O22 Si4 -
2
0.5
Mehmel, M
Ueber die Struktur von Halloysit und Metahalloysit.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,935
90
35
43
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Mehmel, M Ueber die Struktur von Halloysit und Metahalloysit. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 90 (1935) 35-43
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011246.cif $ #-------------------------------------------------------------------...
1,011,247
5.15
null
8.9
null
7.57
null
90
null
100
null
90
null
341.7
null
null
null
null
null
null
null
null
null
heating halloysite to 378 K
by heating halloysite to 378 K
4
C 1 m 1
C -2y
8
Aluminium silicate hydroxide *
Metahalloysite
- Al2 H4 O9 Si2 -
- Al2 H4 O9 Si2 -
- Al4 H8 O18 Si4 -
2
0.5
Mehmel, M
Ueber die Struktur von Halloysit und Metahalloysit.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,935
90
35
43
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Mehmel, M Ueber die Struktur von Halloysit und Metahalloysit. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 90 (1935) 35-43
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011247.cif $ #-------------------------------------------------------------------...
1,011,248
10.19
0.02
10.19
0.02
10.19
0.02
90
null
90
null
90
null
1,058.1
null
null
null
null
null
null
null
null
null
from Binnenthal, Wallis, Switzerland
3
I -4 3 m
I -4 2 3
217
Copper arsenic sulfur (12/4/13)
Tennantite
- As4 Cu12 S13 -
- As4 Cu12 S13 -
- As8 Cu24 S26 -
2
0.041667
Pauling, L; Neumann, E W
The Crystal Structure of Binnite, (Cu, Fe)12 As4 S13 and the Chemical Composition and Structure of Minerals of the Tetrahedrite Group.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
54
62
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pauling, L; Neumann, E W The Crystal Structure of Binnite, (Cu, Fe)12 As4 S13 and the Chemical Composition and Structure of Minerals of the Tetrahedrite Group. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 54-62
282,068
2023-03-26
10:11:44
#------------------------------------------------------------------------------ #$Date: 2023-03-26 11:09:57 +0300 (Sun, 26 Mar 2023) $ #$Revision: 282068 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011248.cif $ #-------------------------------------------------------------------...
1,011,249
9.9
0.03
7.15
0.03
6.1
0.03
90
null
94
0.33
90
null
430.7
null
null
null
null
null
null
null
null
null
4
C 1 2/m 1
-C 2y
12
Magnesium chloride hexahydrate
Bischofite
- Cl2 H12 Mg O6 -
- Cl2 H12 Mg O6 -
- Cl4 H24 Mg2 O12 -
2
0.25
Andress, K R; Gundermann, J
Die Struktur von Magnesiumchlorid- und Magnesiumbromidhexahydrat.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
87
345
369
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Andress, K R; Gundermann, J Die Struktur von Magnesiumchlorid- und Magnesiumbromidhexahydrat. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 87 (1934) 345-369
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011249.cif $ #-------------------------------------------------------------------...
1,011,250
4.049
null
4.049
null
4.049
null
90.3
null
90.3
null
90.3
null
66.4
null
null
null
null
null
null
null
null
null
2
R 3 2 :R
P 3* 2
155
Trinickel disulfide *
Heazlewoodite
- Ni3 S2 -
- Ni3 S2 -
- Ni3 S2 -
1
0.166667
Westgren, A
Die Kristallstruktur von Ni3 S2
Zeitschrift fuer Anorganische und Allgemeine Chemie
1,938
239
82
84
10.1002/zaac.19382390109
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Westgren, A Die Kristallstruktur von Ni3 S2 Zeitschrift fuer Anorganische und Allgemeine Chemie 239 (1938) 82-84
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011250.cif $ #-------------------------------------------------------------------...
1,011,251
5.81
null
5.81
null
5.81
null
90
null
90
null
90
null
196.1
null
null
null
null
null
null
null
null
null
2
F -4 3 m
F -4 2 3
216
Cadmium sulfide
Hawleyite
- Cd S -
- Cd S -
- Cd4 S4 -
4
0.041667
Mueller, W J; Loeffler, G
Zur Kenntnis der Faerbung von gefaelltem Cadmiumsulfid
Angewandte Chemie (German Edition)
1,933
46
538
539
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Mueller, W J; Loeffler, G Zur Kenntnis der Faerbung von gefaelltem Cadmiumsulfid Angewandte Chemie (German Edition) 46 (1933) 538-539
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011251.cif $ #-------------------------------------------------------------------...
1,011,252
7.846
null
7.846
null
5
null
90
null
90
null
90
null
307.8
null
null
null
null
null
null
null
null
null
from Franklin, New Jersey
4
P -4 21 m
P -4 2ab
113
Calcium zinc silicate *
Hardystonite
- Ca2 O7 Si2 Zn -
- Ca2 O7 Si2 Zn -
- Ca4 O14 Si4 Zn2 -
2
0.25
Warren, B E; Trautz, O R
The Structure of Hardystonite Ca2 Zn Si2 O7
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,930
75
525
528
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Warren, B E; Trautz, O R The Structure of Hardystonite Ca2 Zn Si2 O7 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 75 (1930) 525-528
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011252.cif $ #-------------------------------------------------------------------...
7,015,179
9.3222
0.0016
15.499
0.003
17.446
0.003
90
null
96.825
0.003
90
null
2,502.8
0.8
100
2
100
2
null
null
null
null
6
P 1 21/c 1
-P 2ybc
14
work
- C27 H26 Au N4 O3 P -
- C27 H26 Au N4 O3 P -
- C108 H104 Au4 N16 O12 P4 -
4
1
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.0332
0.0254
null
null
0.0568
0.061
null
null
null
null
null
1.081
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
301,847
2025-08-21
11:39:33
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015179.cif $ #-------------------------------------------------------------------...
1,011,253
3.98
0.02
4.33
0.02
11.18
0.02
90
null
90
null
90
null
192.7
null
null
null
null
null
null
null
null
null
synthetic, precipitated from solution
2
P m c n
-P 2n 2a
62
Tin sulfide
Herzenbergite
- S Sn -
- S Sn -
- S4 Sn4 -
4
0.5
Hofmann, W
Ergebnisse der Strukturbestimmung komplexer Sulfide. I: SnS und PbSnS2
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,935
92
161
173
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hofmann, W Ergebnisse der Strukturbestimmung komplexer Sulfide. I: SnS und PbSnS2 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 92 (1935) 161-173
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011253.cif $ #-------------------------------------------------------------------...
1,011,254
13.82
0.005
13.82
0.005
13.82
0.005
90
null
90
null
90
null
2,639.5
null
null
null
null
null
null
null
null
null
from Zuni mine, San Juan Co., Colorado
6
F -4 3 m
F -4 2 3
216
Aluminium silicate hydroxide fluoride chloride *
Zunyite
- Al13 Cl F9 H9 O29 Si5 -
- Al13 Cl F9 H0.375 O29 Si5 -
- Al52 Cl4 F36 H1.5 O116 Si20 -
4
0.041667
Pauling, L
The crystal structure of zunyite, Al13 Si5 O20 ((O H), F)18 Cl
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,933
84
442
452
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pauling, L The crystal structure of zunyite, Al13 Si5 O20 ((O H), F)18 Cl Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 84 (1933) 442-452
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011254.cif $ #-------------------------------------------------------------------...
1,011,255
18.29999
0.1
18.59999
0.1
6.57
0.02
90
null
90
null
90
null
2,236.3
null
null
null
null
null
null
null
null
null
5
F d d 2
F 2 -2d
43
Sodium tecto-alumosilicate hydrate *
Natrolite
- Al2 H4 Na2 O12 Si3 -
- Al2 H4 Na2 O12 Si3 -
- Al16 H32 Na16 O96 Si24 -
8
0.5
Taylor, W H; Meek, C A; Jackson, W W
The structures of fibrous zeolites
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,933
84
373
398
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Taylor, W H; Meek, C A; Jackson, W W The structures of fibrous zeolites Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 84 (1933) 373-398
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011255.cif $ #-------------------------------------------------------------------...
1,011,256
13
null
13
null
6.6
null
90
null
90
null
90
null
1,115.4
null
null
null
null
null
null
null
null
null
from Old Kilpatrick, Dumbartonshire, Scotland
6
P b n m
-P 2c 2ab
62
Sodium calcium tecto-alumosilicate hydrate *
Thomsonite
- Al5 Ca2 H12 Na O26 Si5 -
- Al5 Ca2 H14 Na O20 Si5 -
- Al20 Ca8 H56 Na4 O80 Si20 -
4
0.5
Taylor, W H; Meek, C A; Jackson, W W
The structures of fibrous zeolites
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,933
84
373
398
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Taylor, W H; Meek, C A; Jackson, W W The structures of fibrous zeolites Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 84 (1933) 373-398
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011256.cif $ #-------------------------------------------------------------------...
1,011,257
8.38
null
10.7
null
5.11
null
90
null
90
null
90
null
458.2
null
null
null
null
null
null
null
null
null
from Altenberg, Harz, Germany
4
I m m 2
I 2 -2
44
Tetrazinc dihydroxide hydrate disilicate *
Hemimorphite
- H4 O10 Si2 Zn4 -
- H5 O10 Si2 Zn4 -
- H10 O20 Si4 Zn8 -
2
0.25
Ito, T; West, J
The Structure of Hemimorphite (H2 Zn2 Si O5)
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,932
83
1
8
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ito, T; West, J The Structure of Hemimorphite (H2 Zn2 Si O5) Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 83 (1932) 1-8
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011257.cif $ #-------------------------------------------------------------------...
1,011,258
3.22
null
3.22
null
5.2
null
90
null
90
null
120
null
46.7
null
null
null
null
null
null
null
null
null
synthetic
2
P 63 m c
P 6c -2c
186
Zinc oxide
Zincite
- O Zn -
- O Zn -
- O2 Zn2 -
2
0.166667
Aminoff, G
Ueber Lauephotogramme und Struktur von Zinkit.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,921
56
495
505
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Aminoff, G Ueber Lauephotogramme und Struktur von Zinkit. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 56 (1921) 495-505
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011258.cif $ #-------------------------------------------------------------------...
7,015,178
6.7762
0.0014
17.691
0.004
15.393
0.003
90
null
114.25
0.03
90
null
1,682.5
0.7
100
2
100
2
null
null
null
null
7
P 1 21/c 1
-P 2ybc
14
work
- C14 H14 Au F5 N2 O S -
- C14 H14 Au F5 N2 O S -
- C56 H56 Au4 F20 N8 O4 S4 -
4
1
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.037
0.0278
null
null
0.0585
0.062
null
null
null
null
null
0.972
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015178.cif $ #-------------------------------------------------------------------...
1,011,259
3.351
null
3.351
null
5.226
null
90
null
90
null
120
null
50.8
null
null
null
null
null
null
null
null
null
synthetic
2
P 63 m c
P 6c -2c
186
Zinc oxide
Zincite
- O Zn -
- O Zn -
- O2 Zn2 -
2
0.166667
Weber, L
Die Struktur von Zn O.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,923
58
398
403
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Weber, L Die Struktur von Zn O. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 58 (1923) 398-403
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011259.cif $ #-------------------------------------------------------------------...
1,011,260
5.82
null
5.82
null
5.82
null
90
null
90
null
90
null
197.1
null
null
null
null
null
null
null
null
null
2
F -4 3 m
F -4 2 3
216
Cadmium sulfide - β
Hawleyite
- Cd S -
- Cd S -
- Cd4 S4 -
4
0.041667
Ulrich, F.; Zachariasen, W.
XIV. Über die Kristallstruktur des α- und β-CdS, sowie des Wurtzits
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,925
62
1-6
260
273
10.1524/zkri.1925.62.1.260
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ulrich, F.; Zachariasen, W. XIV. Über die Kristallstruktur des α- und β-CdS, sowie des Wurtzits Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 62(1-6) (1925) 260-273
200,075
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-01 20:47:55 +0300 (Fri, 01 Sep 2017) $ #$Revision: 200075 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011260.cif $ #-------------------------------------------------------------------...
1,011,261
6.58
null
6.58
null
5.93
null
90
null
90
null
90
null
256.7
null
null
null
null
null
null
null
null
null
synthetic
3
I 41/a m d :1
I 4bw 2bw -1bw
141
Zirconium silicate
Zircon
- O4 Si Zr -
- O4 Si Zr -
- O16 Si4 Zr4 -
4
0.125
Hassel, O
Die Kristallstruktur einige Verbindungen von der Zusammensetzung M R O4. I.Zirkon Zr Si O4.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,926
63
247
254
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hassel, O Die Kristallstruktur einige Verbindungen von der Zusammensetzung M R O4. I.Zirkon Zr Si O4. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 63 (1926) 247-254
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011261.cif $ #-------------------------------------------------------------------...
1,011,262
5.762
null
5.762
null
9.439
null
90
null
90
null
90
null
313.4
null
null
null
null
null
null
null
null
null
from Langban, Sweden
2
I 41/a m d :1
I 4bw 2bw -1bw
141
Manganese dimanganese(III) oxide
Hausmannite
- Mn3 O4 -
- Mn3 O4 -
- Mn12 O16 -
4
0.125
Aminoff, G
Ueber die Kristallstruktur von Hausmannit (Mn Mn2 O4).
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,926
64
475
490
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Aminoff, G Ueber die Kristallstruktur von Hausmannit (Mn Mn2 O4). Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 64 (1926) 475-490
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011262.cif $ #-------------------------------------------------------------------...
1,011,263
6.6
null
6.6
null
5.88
null
90
null
90
null
90
null
256.1
null
null
null
null
null
null
null
null
null
from Chantaboon, Siam
3
I 41/a m d :1
I 4bw 2bw -1bw
141
Zirconium silicate
Zircon
- O4 Si Zr -
- O4 Si Zr -
- O16 Si4 Zr4 -
4
0.125
Wyckoff, W G; Hendricks, S B
Die Kristallstruktur von Zirkon und die Kriterien fuer spezielle Lagen in tetragonalen Raumgruppen.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,927
66
73
102
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Wyckoff, W G; Hendricks, S B Die Kristallstruktur von Zirkon und die Kriterien fuer spezielle Lagen in tetragonalen Raumgruppen. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 66 (1927) 73-102
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011263.cif $ #-------------------------------------------------------------------...
1,011,264
9.35
0.02
9.35
0.02
9.35
0.02
90
null
90
null
90
null
817.4
null
null
null
null
null
null
null
null
null
from Simpson, Utah, USA
3
I 21 3
I 2b 2c 3
199
Iron manganese(IV) oxide
Bixbyite C
- Fe Mn O3 -
- Fe Mn O3 -
- Fe16 Mn16 O48 -
16
0.666667
Zachariasen, W
Ueber die Kristallstruktur von Bixbyit, sowie vom kuenstlichen Mn2 O3.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,928
67
455
464
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W Ueber die Kristallstruktur von Bixbyit, sowie vom kuenstlichen Mn2 O3. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 67 (1928) 455-464
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011264.cif $ #-------------------------------------------------------------------...
7,015,177
9.309
0.002
9.355
0.002
11.773
0.003
99.08
0.003
112.817
0.003
96.171
0.003
917
0.4
100
2
100
2
null
null
null
null
7
P -1
-P 1
2
work
- C18 H16 Au F5 N2 O S -
- C18 H16 Au F5 N2 O S -
- C36 H32 Au2 F10 N4 O2 S2 -
2
1
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.0376
0.0315
null
null
0.0743
0.0776
null
null
null
null
null
1.071
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015177.cif $ #-------------------------------------------------------------------...
1,011,265
6.58
null
6.58
null
5.93
null
90
null
90
null
90
null
256.7
null
null
null
null
null
null
null
null
null
from Ural, USSR
3
I 41/a m d :1
I 4bw 2bw -1bw
141
Zirconium silicate
Zircon
- O4 Si Zr -
- O4 Si Zr -
- O16 Si4 Zr4 -
4
0.125
Binks, W
The crystalline structure of zircon.
Mineralogical Magazine and Journal of the Mineralogical Society (1876- 1968)
1,926
21
176
187
10.1180/minmag.1926.021.115.06
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Binks, W The crystalline structure of zircon. Mineralogical Magazine and Journal of the Mineralogical Society (1876- 1968) 21 (1926) 176-187
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011265.cif $ #-------------------------------------------------------------------...
1,011,266
9.365
0.02
9.365
0.02
9.365
0.02
90
null
90
null
90
null
821.3
null
null
null
null
null
null
null
null
null
from Simpson, Utah
3
I a -3
-I 2b 2c 3
206
Iron manganese(IV) oxide
Bixbyite
- Fe Mn O3 -
- Fe Mn O3 -
- Fe16 Mn16 O48 -
16
0.333333
Pauling, L; Shappell, M D
The Crystal Structure of Bixbyite and the C-Modification of the Sesquioxides
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,930
75
128
142
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pauling, L; Shappell, M D The Crystal Structure of Bixbyite and the C-Modification of the Sesquioxides Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 75 (1930) 128-142
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011266.cif $ #-------------------------------------------------------------------...
1,011,267
5.431
0.02
5.431
0.02
5.431
0.02
55.23
0.13
55.23
0.13
55.23
0.13
100.7
null
null
null
null
null
null
null
null
null
2
R -3 c :R
-P 3* 2n
167
Iron(III) oxide
Hematite
- Fe2 O3 -
- Fe2 O3 -
- Fe4 O6 -
2
0.166667
Zachariasen, W H
Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen ABO3
Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse
1,928
1,928
1
165
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W H Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen ABO3 Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse 1928 (1928) 1-165
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011267.cif $ #-------------------------------------------------------------------...
1,011,268
9.75
0.01
12.204
0.02
4.429
0.01
90
null
90
null
90
null
527
null
null
null
null
null
null
null
null
null
from Langesundfjord, Norway
4
P b c a
-P 2ac 2ab
61
Diberyllium borate hydroxide
Hambergite
- B Be2 H O4 -
- B Be2 H O4 -
- B8 Be16 H8 O32 -
8
1
Zachariasen, W H
The crystalline structure of Hambergite Be2 B O3 (O H)
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,931
76
289
302
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W H The crystalline structure of Hambergite Be2 B O3 (O H) Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 76 (1931) 289-302
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011268.cif $ #-------------------------------------------------------------------...
1,011,269
9.39
null
9.39
null
9.39
null
94.4
null
94.4
null
94.4
null
820.2
null
null
null
null
null
null
null
null
null
from Oregon or Greenland or Bohemia
5
R -3 m :R
-P 3* 2
166
Dicalcium tecto-tetraalumooctasilicate dodecahydrate
Chabazite
- Al4 Ca2 H24 O36 Si8 -
- Al3.9996 Ca2 H28 O36 Si8.0004 -
- Al3.9996 Ca2 H28 O36 Si8.0004 -
1
0.083333
Wyart, J
Recherches sur les zeolites
Bulletin de la Societe Francaise de Mineralogie (-71,1948)
1,933
56
81
187
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Wyart, J Recherches sur les zeolites Bulletin de la Societe Francaise de Mineralogie (-71,1948) 56 (1933) 81-187
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011269.cif $ #-------------------------------------------------------------------...
1,011,270
4.8
null
7.68
null
9.8
null
90
null
90.1
null
90
null
361.3
null
null
null
null
null
null
null
null
null
from Obernham, Maine, USA
6
P 1 21/c 1
-P 2ybc
14
Calcium beryllium hydroxide phosphate difluoride
Herderite
- Be Ca F2 H O5 P -
4
1
Strunz, H
Datolith und Herderit
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,936
93
146
150
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Strunz, H Datolith und Herderit Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 93 (1936) 146-150
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011270.cif $ #-------------------------------------------------------------------...
1,011,271
8.168
0.007
8.168
null
8.168
null
90
null
90
null
90
null
544.9
null
null
null
null
null
null
null
null
null
3
null
Potassium hexafluorosilicate
Hieratite
- F6 K2 Si -
1
null
Ketelaar, J. A. A.
Die Kristallstruktur von K-, Rb-, Cs- und Tl-Silicofluorid und von Li Mn O~4~ (H~2~ O)~3~
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,935
92
155
156
10.1524/zkri.1935.92.1.155
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Ketelaar, J. A. A. Die Kristallstruktur von K-, Rb-, Cs- und Tl-Silicofluorid und von Li Mn O~4~ (H~2~ O)~3~ Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 92 (1935) 155-156
189,058
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-12-12 02:48:24 +0200 (Mon, 12 Dec 2016) $ #$Revision: 189058 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011271.cif $ #-------------------------------------------------------------------...
7,015,176
13.684
0.0019
13.5223
0.0018
16.365
0.002
90
null
107.753
0.002
90
null
2,884
0.7
100
2
100
2
null
null
null
null
5
P 1 21/c 1
-P 2ybc
14
work
- C15 H11 Au F5 N3 -
- C15 H11 Au F5 N3 -
- C120 H88 Au8 F40 N24 -
8
2
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.0504
0.0371
null
null
0.0742
0.0804
null
null
null
null
null
1.071
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015176.cif $ #-------------------------------------------------------------------...
1,011,272
6.82
null
6.82
null
6.82
null
61.47
null
61.47
null
61.47
null
231.7
null
null
null
null
null
null
null
null
null
5
R 3 m :R
P 3* -2
160
Strontium trialuminium heptahydroxide diphosphate
Goyazite
- Al3 H7 O14 P2 Sr -
1
0.166667
Gossner, B
Ueber Sulfate und Phosphate mit aehnlichem Kristallgitter
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,937
96
488
492
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Gossner, B Ueber Sulfate und Phosphate mit aehnlichem Kristallgitter Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 96 (1937) 488-492
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011272.cif $ #-------------------------------------------------------------------...
1,011,273
9.8
null
14.1
null
8.66
null
90
null
55.17
null
90
null
982.3
null
null
null
null
null
null
null
null
null
from Strontian, Ecosse, from the Collection of the Museum na
5
P 1 21 1
P 2yb
4
Barium alumosilicate hydrate *
Harmotome
- Al2 Ba H12 O22 Si6 -
2
1
Sekanina, J; Wyart, J
Sur l'harmotome
Bulletin de la Societe Francaise de Mineralogie (-71,1948)
1,937
60
139
145
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Sekanina, J; Wyart, J Sur l'harmotome Bulletin de la Societe Francaise de Mineralogie (-71,1948) 60 (1937) 139-145
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011273.cif $ #-------------------------------------------------------------------...
1,011,274
9.6
null
11.4
null
16.84
null
90
null
69
null
90
null
1,720.6
null
null
null
null
null
null
null
null
null
from Scawt Hill, Co. Antrim
4
P 1 21 1
P 2yb
4
Tetracalcium dialuminium oxide dodecahydrate
Hydrocalumite
- Al2 Ca4 H24 O19 -
4
2
Tilley, C E; Megaw, H D; Hey, M H
Hydrocalumite ((Ca O)4 (Al2 O3) (H2 O)12), a new mineral from Scawt Hill, Co. Antrim.
Mineralogical Magazine and Journal of the Mineralogical Society (1876- 1968)
1,934
23
607
615
10.1180/minmag.1934.023.146.04
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
Tilley, C E; Megaw, H D; Hey, M H Hydrocalumite ((Ca O)4 (Al2 O3) (H2 O)12), a new mineral from Scawt Hill, Co. Antrim. Mineralogical Magazine and Journal of the Mineralogical Society (1876- 1968) 23 (1934) 607-615
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011274.cif $ #-------------------------------------------------------------------...
1,011,275
16.019
null
16.019
null
9.768
null
90
null
90
null
120
null
2,170.7
null
null
null
null
null
null
null
null
null
synthetic
4
P -3 1 m
-P 3 2
162
Nickel hexaaquahexoxoantimonate hexahydrate
Bottinoite
- H24 Ni O18 Sb2 -
- H2 Ni O3.83333 Sb2 -
- H12 Ni6 O23 Sb12 -
6
0.5
Beintema, J
On the crystal-structure of magnesium- and nickelantimonate.
Proceedings of the Koninklijke Nederlandse Academie van Wetenschappen
1,936
39
241
252
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Beintema, J On the crystal-structure of magnesium- and nickelantimonate. Proceedings of the Koninklijke Nederlandse Academie van Wetenschappen 39 (1936) 241-252
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011275.cif $ #-------------------------------------------------------------------...
1,011,276
8.41
0.01
8.41
0.01
8.41
0.01
90
null
90
null
90
null
594.8
null
null
null
null
null
null
null
null
null
synthetic
3
F d -3 m :1
F 4d 2 3 -1d
227
Dimagnesium titanium oxide
Qandilite
- Mg2 O4 Ti -
- Mg2 O4 Ti -
- Mg16 O32 Ti8 -
8
0.041667
Barth, T F W; Posnjak, E
Spinel structures: with and without variate atom equipoints
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,932
82
325
341
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Barth, T F W; Posnjak, E Spinel structures: with and without variate atom equipoints Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 82 (1932) 325-341
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011276.cif $ #-------------------------------------------------------------------...
1,011,277
5.92
null
5.92
null
5.92
null
90
null
90
null
90
null
207.5
null
null
null
null
null
null
null
null
null
2
P n -3 m :1
P 4n 2 3 -1n
224
Magnesium phosphide
- Mg3 P2 -
- Mg3 P2 -
- Mg6 P4 -
2
0.041667
Passerini, L
Struttura cristallina di alcuni fosfuri di metalli bivalenti e trivalenti
Gazzetta Chimica Italiana
1,928
58
655
664
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Passerini, L Struttura cristallina di alcuni fosfuri di metalli bivalenti e trivalenti Gazzetta Chimica Italiana 58 (1928) 655-664
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011277.cif $ #-------------------------------------------------------------------...
1,011,278
8.28
0.005
8.28
0.005
8.28
0.005
90
null
90
null
90
null
567.7
null
null
null
null
null
null
null
null
null
synthetic
3
F d -3 m :1
F 4d 2 3 -1d
227
Zinc dichromium oxide
Zincochromite
- Cr2 O4 Zn -
- Cr2 O4 Zn -
- Cr16 O32 Zn8 -
8
0.041667
Passerini, L
Ricerche sugli Spinelle.- II. I composti. Cu Al2 O4, Mg Al2 O4, Mg Fe2 O4, Zn Al2 O4, Zn Cr2 O4, Zn Fe2 O4, Mn Fe2 O4
Gazzetta Chimica Italiana
1,930
60
389
399
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Passerini, L Ricerche sugli Spinelle.- II. I composti. Cu Al2 O4, Mg Al2 O4, Mg Fe2 O4, Zn Al2 O4, Zn Cr2 O4, Zn Fe2 O4, Mn Fe2 O4 Gazzetta Chimica Italiana 60 (1930) 389-399
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011278.cif $ #-------------------------------------------------------------------...
7,015,175
6.9494
0.0014
13.498
0.003
14.301
0.003
108.286
0.003
101.346
0.003
91.652
0.003
1,242.9
0.5
100
2
100
2
null
null
null
null
4
P -1
-P 1
2
work
- C5 H8 N2 S -
- C5 H8 N2 S -
- C40 H64 N16 S8 -
8
4
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.0774
0.0457
null
null
0.0807
0.0886
null
null
null
null
null
0.88
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
301,847
2025-08-21
11:39:33
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015175.cif $ #-------------------------------------------------------------------...
1,011,279
10.23
null
10.23
null
10.23
null
90
null
90
null
90
null
1,070.6
null
null
null
null
null
null
null
null
null
synthetic
3
F d -3 m :2
-F 4vw 2vw 3
227
Silver catena-antimonate
Stetefeldite
- Ag O3 Sb -
- Ag O3 Sb -
- Ag16 O48 Sb16 -
16
0.083333
Schrewelius, N
Roentgenuntersuchung der Verbindungen Na Sb (O H)6, Na Sb F6, Na Sb O3 und gleichartiger Stoffe
Zeitschrift fuer Anorganische und Allgemeine Chemie
1,938
238
241
254
10.1002/zaac.19382380209
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Schrewelius, N Roentgenuntersuchung der Verbindungen Na Sb (O H)6, Na Sb F6, Na Sb O3 und gleichartiger Stoffe Zeitschrift fuer Anorganische und Allgemeine Chemie 238 (1938) 241-254
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011279.cif $ #-------------------------------------------------------------------...
1,011,280
6.24
null
6.43
null
4.2
null
90
null
90
null
90
null
168.5
null
null
null
null
null
null
null
null
null
synthetic
2
P n n m
-P 2 2n
58
Calcium chloride
Hydrophilite
- Ca Cl2 -
- Ca Cl2 -
- Ca2 Cl4 -
2
0.25
van Bever, A K; Nieuwenkamp, W
Die Kristallstruktur von Calciumchlorid, Ca Cl2
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,935
90
374
376
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
van Bever, A K; Nieuwenkamp, W Die Kristallstruktur von Calciumchlorid, Ca Cl2 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 90 (1935) 374-376
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011280.cif $ #-------------------------------------------------------------------...
1,011,281
10.39
null
10.39
null
10.39
null
90
null
90
null
90
null
1,121.6
null
null
null
null
null
null
null
null
null
2
I 21 3
I 2b 2c 3
199
Lutetium oxide
- Lu2 O3 -
- Lu2 O3 -
- Lu32 O48 -
16
0.666667
Zachariasen, W
The crystal structure of the modification C of the sesquioxides of the rare earth metals, and of indium and thallium.
Norsk Geologisk Tidsskrift
1,927
9
310
316
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W The crystal structure of the modification C of the sesquioxides of the rare earth metals, and of indium and thallium. Norsk Geologisk Tidsskrift 9 (1927) 310-316
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011281.cif $ #-------------------------------------------------------------------...
1,011,282
4.78
null
4.78
null
4.78
null
90
null
90
null
90
null
109.2
null
null
null
null
null
null
null
null
null
synthetic
2
F m -3 m
-F 4 2 3
225
Sodium fluoride
Villiaumite
- F Na -
- F Na -
- F4 Na4 -
4
0.020833
Bragg, W L
Crystal structure of Na F
Nature (London)
1,920
105
646
648
10.1038/105646a0
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bragg, W L Crystal structure of Na F Nature (London) 105 (1920) 646-648
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011282.cif $ #-------------------------------------------------------------------...
1,011,283
15.19
null
8.67
null
4.53
null
90
null
90
null
90
null
596.6
null
null
null
null
null
null
null
null
null
from Pisek, Bohemia
4
C c m 21
C 2c -2c
36
Tetraberyllium disilicate dihydroxide
Bertrandite
- Be4 H2 O9 Si2 -
- Be4 H3 O9 Si2 -
- Be16 H12 O36 Si8 -
4
0.5
Ito, T; West, J
The structure of bertrandite (H2 Be4 Si2 O9)
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,932
83
384
393
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ito, T; West, J The structure of bertrandite (H2 Be4 Si2 O9) Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 83 (1932) 384-393
176,435
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011283.cif $ #-------------------------------------------------------------------...
1,011,284
12.1
null
12.1
null
12.1
null
90
null
90
null
90
null
1,771.6
null
null
null
null
null
null
null
null
null
4
F -4 3 c
F -4a 2 3
219
Magnesium borate chloride *
Boracite
- B14 Cl2 Mg6 O26 -
- B14 Cl2 Mg6 O26 -
- B56 Cl8 Mg24 O104 -
4
0.041667
Mehmel, M
Kristallstrukturelle Untersuchungen an Borazit
Fortschritte der Mineralogie
1,932
17
436
438
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Mehmel, M Kristallstrukturelle Untersuchungen an Borazit Fortschritte der Mineralogie 17 (1932) 436-438
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011284.cif $ #-------------------------------------------------------------------...
1,011,285
6.016
null
5.428
null
3.366
null
90
null
90
null
90
null
109.9
null
null
null
null
null
null
null
null
null
synthetic at 1003 K for 1d
2
P b n m
-P 2c 2ab
62
Iron arsenide (1/1)
Westerveldite
- As Fe -
- As Fe -
- As4 Fe4 -
4
0.5
Fylking, K E
Phosphides and arsenides with modified nickel-arsenide structure
Arkiv foer Kemi, Mineralogi och Geologi, B
1,934
11
48
1
6
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Fylking, K E Phosphides and arsenides with modified nickel-arsenide structure Arkiv foer Kemi, Mineralogi och Geologi, B 11(48) (1934) 1-6
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011285.cif $ #-------------------------------------------------------------------...
1,011,286
3.14
null
3.14
null
12.53
null
90
null
90
null
120
null
107
null
null
null
null
null
null
null
null
null
2
P 63/m m c
-P 6c 2c
194
Molybdenum(IV) sulfide
Molybdenite 2H
- Mo S2 -
- Mo S2 -
- Mo2 S4 -
2
0.083333
Hassel, O
Ueber die Kristallstruktur des Molybdaenglanzes.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,925
61
92
99
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Hassel, O Ueber die Kristallstruktur des Molybdaenglanzes. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 61 (1925) 92-99
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011286.cif $ #-------------------------------------------------------------------...
7,015,174
11.348
0.003
12.09
0.004
8.619
0.003
90
null
98.098
0.005
90
null
1,170.7
0.6
100
2
100
2
null
null
null
null
4
P 1 21/c 1
-P 2ybc
14
work
- C9 H17 N3 O3 -
- C9 H17 N3 O3 -
- C36 H68 N12 O12 -
4
1
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C.
Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity.
Dalton transactions (Cambridge, England : 2003)
2,011
40
7
1471
1483
10.1039/c0dt01312a
0.71073
MoKα
0.0728
0.0614
null
null
0.1331
0.139
null
null
null
null
null
1.11
null
null
has coordinates
Coetzee, Jacorien; Cronje, Stephanie; Dobrzańska, Liliana; Raubenheimer, Helgard G.; Jooné, Gisela; Nell, Margo J.; Hoppe, Heinrich C. Novel N-heterocyclic ylideneamine gold(I) complexes: synthesis, characterisation and screening for antitumour and antimalarial activity. Dalton transactions (Cambridge, England : 2003) ...
301,847
2025-08-21
11:39:33
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015174.cif $ #-------------------------------------------------------------------...
1,011,287
10.86
0.02
10.86
0.02
10.86
0.02
90
null
90
null
90
null
1,280.8
null
null
null
null
null
null
null
null
null
2
I 21 3
I 2b 2c 3
199
Europium oxide
- Eu2 O3 -
- Eu2 O3 -
- Eu32 O48 -
16
0.666667
Zachariasen, W H
Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen A B O3
Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse
1,928
1,928
1
165
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W H Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen A B O3 Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse 1928 (1928) 1-165
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011287.cif $ #-------------------------------------------------------------------...
1,011,288
10.81
0.02
10.81
0.02
10.81
0.02
90
null
90
null
90
null
1,263.2
null
null
null
null
null
null
null
null
null
2
I 21 3
I 2b 2c 3
199
Gadolinium oxide
- Gd2 O3 -
- Gd2 O3 -
- Gd32 O48 -
16
0.666667
Zachariasen, W H
Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen A B O3
Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse
1,928
1,928
1
165
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W H Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen A B O3 Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse 1928 (1928) 1-165
202,026
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-16 01:16:12 +0300 (Mon, 16 Oct 2017) $ #$Revision: 202026 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011288.cif $ #-------------------------------------------------------------------...
1,011,289
10.72
0.02
10.72
0.02
10.72
0.02
90
null
90
null
90
null
1,231.9
null
null
null
null
null
null
null
null
null
2
I 21 3
I 2b 2c 3
199
Terbium oxide
- O3 Tb2 -
- O3 Tb2 -
- O48 Tb32 -
16
0.666667
Zachariasen, W H
Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen ABO~3~
Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse
1,928
1,928
1
165
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Zachariasen, W H Untersuchungen ueber die Kristallstruktur von Sesquioxyden und Verbindungen ABO~3~ Skrifter utgitt av det Norske Videnskaps-Akademi i Oslo 1: Matematisk- Naturvidenskapelig Klasse 1928 (1928) 1-165
202,026
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-16 01:16:12 +0300 (Mon, 16 Oct 2017) $ #$Revision: 202026 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011289.cif $ #-------------------------------------------------------------------...
1,011,290
5.76
null
5.76
null
4.77
null
90
null
90
null
120
null
137.1
null
null
null
null
null
null
null
null
null
4
P -3 m 1
-P 3 2"
164
Diammonium hexafluorosilicate
Bararite
- F6 H8 N2 Si -
- F6 H8 N2 Si -
- F6 H8 N2 Si -
1
0.083333
Gossner, B; Kraus, O
Das Kristallgitter von Ammoniumhexafluorosilikat (N H4)2 Si F6
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
223
225
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Gossner, B; Kraus, O Das Kristallgitter von Ammoniumhexafluorosilikat (N H4)2 Si F6 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 223-225
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011290.cif $ #-------------------------------------------------------------------...
1,011,291
11.503
0.01
4.369
0.005
3.557
0.005
90
null
90
null
90
null
178.8
null
null
null
null
null
null
null
null
null
synthetic from melt
2
P m n 21
P 2ac -2
31
Vanadium oxide
Shcherbianite
- O5 V2 -
- O5 V2 -
- O10 V4 -
2
0.5
Ketelaar, J A A
Die Kristallstruktur des Vanadiumpentoxyds
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,936
95
9
27
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ketelaar, J A A Die Kristallstruktur des Vanadiumpentoxyds Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 95 (1936) 9-27
303,120
2025-10-31
16:25:08
#------------------------------------------------------------------------------ #$Date: 2025-10-31 18:24:25 +0200 (Fri, 31 Oct 2025) $ #$Revision: 303120 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011291.cif $ #-------------------------------------------------------------------...
7,015,173
16.0297
0.0017
16.1944
0.0017
17.5912
0.0018
98.066
0.006
97.01
0.01
105.495
0.006
4,295.7
0.8
150
2
150
2
null
null
null
null
6
P -1
-P 1
2
- C42 H30 Br2 N8 Ni O2 -
- C42 H30 Br2 N8 Ni O2 -
- C168 H120 Br8 N32 Ni4 O8 -
4
2
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang
New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3365
3380
10.1039/c0dt01308k
x-ray
0.71073
MoKα
0.1112
0.0641
null
null
0.1664
0.183
null
null
null
null
null
0.938
null
null
has coordinates
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts. Dalton transactions (Cambridge, England : 2003) 40(13) (20...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015173.cif $ #-------------------------------------------------------------------...
1,011,292
9.6
null
9.6
null
9.6
null
90
null
90
null
90
null
884.7
null
null
null
null
null
null
null
null
null
3
P n -3 :1
P 2 2 3 -1n
201
Potassium catena-antimonate
- K O3 Sb -
- K O3 Sb -
- K12 O36 Sb12 -
12
0.5
Spiegelberg, P
X-ray studies on potassium antimonates
Arkiv foer Kemi, Mineralogi och Geologi, A
1,940
14
1
12
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Spiegelberg, P X-ray studies on potassium antimonates Arkiv foer Kemi, Mineralogi och Geologi, A 14 (1940) 1-12
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011292.cif $ #-------------------------------------------------------------------...
1,011,293
6.16
null
6.16
null
6.16
null
33.43
null
33.43
null
33.43
null
63.2
null
null
null
null
null
null
null
null
null
2
R -3 m :R
-P 3* 2
166
Cobalt chloride
- Cl2 Co -
- Cl2 Co -
- Cl2 Co -
1
0.083333
Grime, H; Santos, J A
The structure and colour of anhydrous cobalt chloride Co Cl2, at room and very low temperatures
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
136
141
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Grime, H; Santos, J A The structure and colour of anhydrous cobalt chloride Co Cl2, at room and very low temperatures Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 136-141
282,068
2023-03-26
10:11:44
#------------------------------------------------------------------------------ #$Date: 2023-03-26 11:09:57 +0300 (Sun, 26 Mar 2023) $ #$Revision: 282068 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011293.cif $ #-------------------------------------------------------------------...
1,011,294
7.45
null
7.45
null
7.88
null
90
null
90
null
90
null
437.4
null
null
null
null
null
null
null
null
null
synthetic by slow evaporation
5
P 42/m n m
-P 4n 2n
136
Dipotassium copper tetrachloride dihydrate
Mitscherlichite
- Cl4 Cu H4 K2 O2 -
- Cl4 Cu H4 K2 O2 -
- Cl8 Cu2 H8 K4 O4 -
2
0.125
Chrobak, L
Quantitative spectrometric studies of ammonium and of potassium cupric chloride dihydrate (N H4)2 Cu Cl4 (H2 O)2 and K2 Cu Cl4 (H2 O)2
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
35
47
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Chrobak, L Quantitative spectrometric studies of ammonium and of potassium cupric chloride dihydrate (N H4)2 Cu Cl4 (H2 O)2 and K2 Cu Cl4 (H2 O)2 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 35-47
296,116
2024-11-26
15:33:35
#------------------------------------------------------------------------------ #$Date: 2024-11-26 17:33:34 +0200 (Tue, 26 Nov 2024) $ #$Revision: 296116 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011294.cif $ #-------------------------------------------------------------------...
1,011,295
10.721
null
5.243
null
6.44
null
90
null
90
null
90
null
362
null
null
null
null
null
null
null
null
null
synthetic from solution at 346 K
4
P c a 21
P 2c -2ac
29
Sodium carbonate hydrate
Thermonatrite
- C H2 Na2 O4 -
- C H2 Na2 O4 -
- C4 H8 Na8 O16 -
4
1
Harper, J P
Crystal structure of sodium carbonate monohydrate, Na2 C O3 H2 O
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,936
95
266
273
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Harper, J P Crystal structure of sodium carbonate monohydrate, Na2 C O3 H2 O Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 95 (1936) 266-273
208,902
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2018-07-07 04:59:37 +0300 (Sat, 07 Jul 2018) $ #$Revision: 208902 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011295.cif $ #-------------------------------------------------------------------...
1,011,296
5.644
0.003
5.644
null
5.644
null
90
null
90
null
90
null
179.8
null
null
null
null
null
null
null
null
null
2
P m -3 m
-P 4 2 3
221
Yttrium fluoride
- F3 Y -
- F3 Y -
- F9 Y3 -
3
0.0625
Nowacki, W
Die Kristallstruktur des kubischen Yttriumfluorids Y F3
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,938
100
242
250
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Nowacki, W Die Kristallstruktur des kubischen Yttriumfluorids Y F3 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 100 (1938) 242-250
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011296.cif $ #-------------------------------------------------------------------...
1,011,297
11.86
null
12.08
null
6.81
null
90
null
90
null
90
null
975.7
null
null
null
null
null
null
null
null
null
4
P 21 21 21
P 2ac 2ab
19
Nickel sulfate(VI) heptahydrate
Morenosite
- H14 Ni O11 S -
- H14 Ni O11 S -
- H56 Ni4 O44 S4 -
4
1
Beevers, C A; Schwartz, C M
The crystal structure of nickel sulphate heptahydrate Ni S O4 (H2 O)7
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,935
91
157
169
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Beevers, C A; Schwartz, C M The crystal structure of nickel sulphate heptahydrate Ni S O4 (H2 O)7 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 91 (1935) 157-169
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011297.cif $ #-------------------------------------------------------------------...
7,015,172
9.91
0.0012
15.452
0.002
15.745
0.002
109.997
0.008
103.44
0.01
94.45
0.008
2,170.8
0.5
150
2
150
2
null
null
null
null
5
P -1
-P 1
2
- C44 H33 Br2 N9 Ni -
- C44 H33 Br2 N9 Ni -
- C88 H66 Br4 N18 Ni2 -
2
1
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang
New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3365
3380
10.1039/c0dt01308k
x-ray
0.71073
MoKα
0.1156
0.0633
null
null
0.1546
0.1735
null
null
null
null
null
0.944
null
null
has coordinates
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts. Dalton transactions (Cambridge, England : 2003) 40(13) (20...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015172.cif $ #-------------------------------------------------------------------...
1,011,298
3.627
null
3.627
null
5.973
null
90
null
90
null
90
null
78.6
null
null
null
null
null
null
null
null
null
2
P 4/n m m :1
P 4ab 2ab -1ab
129
Iron arsenide (2/1)
- As Fe2 -
- As Fe2 -
- As2 Fe4 -
2
0.125
Elander, M; Haegg, G; Westgren, A
The crystal structure of Cu2 Sb and Fe2 As
Arkiv foer Kemi, Mineralogi och Geologi, B
1,935
12
1
6
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Elander, M; Haegg, G; Westgren, A The crystal structure of Cu2 Sb and Fe2 As Arkiv foer Kemi, Mineralogi och Geologi, B 12 (1935) 1-6
176,729
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-02-18 17:37:37 +0200 (Thu, 18 Feb 2016) $ #$Revision: 176729 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011298.cif $ #-------------------------------------------------------------------...
1,011,299
4.712
0.003
4.712
0.003
4.712
0.003
90
null
90
null
90
null
104.6
null
null
null
null
null
null
null
null
null
2
P m -3 n
-P 4n 2 3
223
Vanadium silicide (3/1)
- Si V3 -
- Si V3 -
- Si2 V6 -
2
0.041667
Wallbaum, H J
Ueber das Vanadiumsilicid, V3 Si
Zeitschrift fuer Metallkunde
1,939
31
362
362
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Wallbaum, H J Ueber das Vanadiumsilicid, V3 Si Zeitschrift fuer Metallkunde 31 (1939) 362-362
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/12/1011299.cif $ #-------------------------------------------------------------------...
1,011,300
3.988
null
3.988
null
3.988
null
90
null
90
null
90
null
63.4
null
null
null
null
null
null
null
null
null
3
P m -3 m
-P 4 2 3
221
Ammonium bromide
- Br H4 N -
- Br H4 N -
- Br H4 N -
1
0.020833
Bartlett, G; Langmuir, I
The crystal structure of the ammonium halides above and below the transition temperature
Journal of the American Chemical Society
1,921
43
84
91
10.1021/ja01434a010
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Bartlett, G; Langmuir, I The crystal structure of the ammonium halides above and below the transition temperature Journal of the American Chemical Society 43 (1921) 84-91
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011300.cif $ #-------------------------------------------------------------------...
1,011,301
5.42
null
5.42
null
5.42
null
90
null
90
null
90
null
159.2
null
null
null
null
null
null
null
null
null
2
F -4 3 m
F -4 2 3
216
Aluminium phosphide
- Al P -
- Al P -
- Al4 P4 -
4
0.041667
Passerini, L
Struttura cristallina di alcuni fosfuri di metalli bivalenti e trivalenti
Gazzetta Chimica Italiana
1,928
58
655
664
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Passerini, L Struttura cristallina di alcuni fosfuri di metalli bivalenti e trivalenti Gazzetta Chimica Italiana 58 (1928) 655-664
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011301.cif $ #-------------------------------------------------------------------...
1,011,302
10.67
null
10.67
null
10.67
null
90
null
90
null
90
null
1,214.8
null
null
null
null
null
null
null
null
null
4
F m -3 m
-F 4 2 3
225
Dibarium nickel nitrate(III)
- Ba2 N6 Ni O12 -
- Ba2 N6 Ni O12 -
- Ba8 N24 Ni4 O48 -
4
0.020833
Ferrari, A; Curti, R
Ricerche chimiche e cristallografiche sui nichelnitriti di metalli bivalenti
Gazzetta Chimica Italiana
1,933
63
499
506
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ferrari, A; Curti, R Ricerche chimiche e cristallografiche sui nichelnitriti di metalli bivalenti Gazzetta Chimica Italiana 63 (1933) 499-506
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011302.cif $ #-------------------------------------------------------------------...
1,011,303
10.54
null
10.54
null
10.54
null
90
null
90
null
90
null
1,170.9
null
null
null
null
null
null
null
null
null
4
F m -3 m
-F 4 2 3
225
Distrontium nickel nitrate(III)
- N6 Ni O12 Sr2 -
- N6 Ni O12 Sr2 -
- N24 Ni4 O48 Sr8 -
4
0.020833
Ferrari, A; Curti, R
Ricerche chimiche e cristallografiche sui nichelnitriti di metalli bivalenti
Gazzetta Chimica Italiana
1,933
63
499
506
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ferrari, A; Curti, R Ricerche chimiche e cristallografiche sui nichelnitriti di metalli bivalenti Gazzetta Chimica Italiana 63 (1933) 499-506
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011303.cif $ #-------------------------------------------------------------------...
1,011,304
10.55
null
10.55
null
10.55
null
90
null
90
null
90
null
1,174.2
null
null
null
null
null
null
null
null
null
4
F m -3 m
-F 4 2 3
225
Dilead nickel nitrate(III)
- N6 Ni O12 Pb2 -
- N6 Ni O12 Pb2 -
- N24 Ni4 O48 Pb8 -
4
0.020833
Ferrari, A; Curti, R
Ricerche chimiche e cristallografiche sui nichelnitriti di metalli bivalenti
Gazzetta Chimica Italiana
1,933
63
499
506
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ferrari, A; Curti, R Ricerche chimiche e cristallografiche sui nichelnitriti di metalli bivalenti Gazzetta Chimica Italiana 63 (1933) 499-506
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011304.cif $ #-------------------------------------------------------------------...
1,011,305
4.29
null
4.29
null
4.29
null
90
null
90
null
90
null
79
null
null
null
null
null
null
null
null
null
3
P m -3 m
-P 4 2 3
221
Caesium hydrogensulfide
- Cs H S -
- Cs H S -
- Cs H S -
1
0.020833
West, C D
The crystal structures of some alkali hydrosulfides and monosulfides.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
97
115
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
West, C D The crystal structures of some alkali hydrosulfides and monosulfides. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 97-115
200,452
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-11 16:25:09 +0300 (Mon, 11 Sep 2017) $ #$Revision: 200452 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011305.cif $ #-------------------------------------------------------------------...
7,015,171
14.515
0.0018
11.79
0.0014
18.222
0.002
90
null
101.602
0.005
90
null
3,054.7
0.6
150
2
150
2
null
null
null
null
3
P 1 21/c 1
-P 2ybc
14
- C40 H26 N8 -
- C40 H26 N8 -
- C160 H104 N32 -
4
1
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang
New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3365
3380
10.1039/c0dt01308k
x-ray
0.71073
MoKα
0.1021
0.0444
null
null
0.0894
0.102
null
null
null
null
null
0.947
null
null
has coordinates
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts. Dalton transactions (Cambridge, England : 2003) 40(13) (20...
301,847
2025-08-21
11:39:33
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015171.cif $ #-------------------------------------------------------------------...
1,011,306
6.05
null
6.05
null
6.05
null
90
null
90
null
90
null
221.4
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Sodium hydrogensulfide - HT
- H Na S -
- H Na S -
- H4 Na4 S4 -
4
0.020833
West, C D
The crystal structures of some alkali hydrosulfides and monohydrides.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
97
115
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
West, C D The crystal structures of some alkali hydrosulfides and monohydrides. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 97-115
287,670
2023-11-17
14:28:49
#------------------------------------------------------------------------------ #$Date: 2023-11-17 16:28:22 +0200 (Fri, 17 Nov 2023) $ #$Revision: 287670 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011306.cif $ #-------------------------------------------------------------------...
1,011,307
6.6
null
6.6
null
6.6
null
90
null
90
null
90
null
287.5
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Potassium hydrogensulfide - HT
- H K S -
- H K S -
- H4 K4 S4 -
4
0.020833
West, C. D.
The crystal structures of some alkali hydrosulfides and monosulfides.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
97
115
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
West, C. D. The crystal structures of some alkali hydrosulfides and monosulfides. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 97-115
287,670
2023-11-17
14:28:49
#------------------------------------------------------------------------------ #$Date: 2023-11-17 16:28:22 +0200 (Fri, 17 Nov 2023) $ #$Revision: 287670 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011307.cif $ #-------------------------------------------------------------------...
1,011,308
6.93
null
6.93
null
6.93
null
90
null
90
null
90
null
332.8
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Rubidium hydrogensulfide
- H Rb S -
- H Rb S -
- H4 Rb4 S4 -
4
0.020833
West, C D
The crystal structures of some alkali hydrosulfides and monosulfides.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
97
115
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
West, C D The crystal structures of some alkali hydrosulfides and monosulfides. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 97-115
200,452
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-09-11 16:25:09 +0300 (Mon, 11 Sep 2017) $ #$Revision: 200452 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011308.cif $ #-------------------------------------------------------------------...
1,011,309
7.35
null
7.35
null
7.35
null
90
null
90
null
90
null
397.1
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Potassium sulfide
- K2 S -
- K2 S -
- K8 S4 -
4
0.020833
West, C D
The crystal structures of some alkali hydrosulfides and monosulfides.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
88
97
115
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
West, C D The crystal structures of some alkali hydrosulfides and monosulfides. Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 88 (1934) 97-115
282,068
2023-03-26
10:11:44
#------------------------------------------------------------------------------ #$Date: 2023-03-26 11:09:57 +0300 (Sun, 26 Mar 2023) $ #$Revision: 282068 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011309.cif $ #-------------------------------------------------------------------...
1,011,310
4.145
0.005
4.145
0.005
4.145
0.005
90
null
90
null
90
null
71.2
null
null
null
null
null
null
null
null
null
2
P m -3 m
-P 4 2 3
221
Calcium boride (1/6)
- B6 Ca -
- B6 Ca -
- B6 Ca -
1
0.020833
Pauling, L; Weinbaum, S
The structure of calcium boride, Ca B6
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,934
87
181
182
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Pauling, L; Weinbaum, S The structure of calcium boride, Ca B6 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 87 (1934) 181-182
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011310.cif $ #-------------------------------------------------------------------...
1,011,311
9.729
0.02
9.729
0.02
9.729
0.02
90
null
90
null
90
null
920.9
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Dipotassium hexachloroosmate(IV)
- Cl6 K2 Os -
- Cl6 K2 Os -
- Cl24 K8 Os4 -
4
0.020833
McCullough, J D
The crystal structure of potassium chlorosmate, K2 Os Cl6, and of potassium bromosmate, K2 Os Br6
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,936
94
143
149
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
McCullough, J D The crystal structure of potassium chlorosmate, K2 Os Cl6, and of potassium bromosmate, K2 Os Br6 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 94 (1936) 143-149
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011311.cif $ #-------------------------------------------------------------------...
7,015,170
9.264
0.003
11.425
0.003
16.053
0.005
79.809
0.018
82.01
0.017
83.249
0.019
1,648.5
0.9
150
2
150
2
null
null
null
null
3
P -1
-P 1
2
- C42 H30 N8 -
- C42 H30 N8 -
- C84 H60 N16 -
2
1
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang
New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3365
3380
10.1039/c0dt01308k
x-ray
0.71073
MoKα
0.2017
0.0596
null
null
0.0997
0.1243
null
null
null
null
null
0.832
null
null
has coordinates
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts. Dalton transactions (Cambridge, England : 2003) 40(13) (20...
301,847
2025-08-21
11:39:33
#------------------------------------------------------------------------------ #$Date: 2025-08-21 14:21:36 +0300 (Thu, 21 Aug 2025) $ #$Revision: 301847 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015170.cif $ #-------------------------------------------------------------------...
1,011,312
10.3
0.03
10.3
0.03
10.3
0.03
90
null
90
null
90
null
1,092.7
null
null
null
null
null
null
null
null
null
3
F m -3 m
-F 4 2 3
225
Dipotassium hexabromoosmate(IV)
- Br6 K2 Os -
- Br6 K2 Os -
- Br24 K8 Os4 -
4
0.020833
McCullough, J D
The crystal structure of potassium chlorosmate, K2 Os Cl6, and of potassium bromosmate, K2 Os Br6
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)
1,936
94
143
149
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
McCullough, J D The crystal structure of potassium chlorosmate, K2 Os Cl6, and of potassium bromosmate, K2 Os Br6 Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977) 94 (1936) 143-149
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011312.cif $ #-------------------------------------------------------------------...
1,011,313
3.742
null
3.742
null
3.742
null
90
null
90
null
90
null
52.4
null
null
null
null
null
null
null
null
null
2
P m -3 m
-P 4 2 3
221
Rubidium chloride - $-alpha
- Cl Rb -
- Cl Rb -
- Cl Rb -
1
0.020833
Wagner, G; Lippert, L
Ueber polymorphe Umwandlungen bei einfachen Ionengittern. II. Versuche zur Umwandlung: Na Cl vers. Cs Cl - Gitter.
Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie
1,936
33
297
303
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Wagner, G; Lippert, L Ueber polymorphe Umwandlungen bei einfachen Ionengittern. II. Versuche zur Umwandlung: Na Cl vers. Cs Cl - Gitter. Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie 33 (1936) 297-303
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011313.cif $ #-------------------------------------------------------------------...
1,011,314
5.12952
0.00004
5.12952
0.00004
5.12952
0.00004
90
null
90
null
90
null
135
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Lithium chloride
- Cl Li -
- Cl Li -
- Cl4 Li4 -
4
0.020833
Ievin'sh, A F; Straumanis, M; Karlsons, K
Praezisionsbestimmung von Gitterkonstanten hygroskopischer Verbindungen (Li Cl, Na Br).
Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie
1,938
40
146
150
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ievin'sh, A F; Straumanis, M; Karlsons, K Praezisionsbestimmung von Gitterkonstanten hygroskopischer Verbindungen (Li Cl, Na Br). Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie 40 (1938) 146-150
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011314.cif $ #-------------------------------------------------------------------...
1,011,315
5.96095
0.00005
5.96095
0.00005
5.96095
0.00005
90
null
90
null
90
null
211.8
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Sodium bromide
- Br Na -
- Br Na -
- Br4 Na4 -
4
0.020833
Ievin'sh, A F; Straumanis, M; Karlsons, K
Praezisionsbestimmung von Gitterkonstanten hygroskopischer Verbindungen (Li Cl, Na Br).
Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie
1,938
40
146
150
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Ievin'sh, A F; Straumanis, M; Karlsons, K Praezisionsbestimmung von Gitterkonstanten hygroskopischer Verbindungen (Li Cl, Na Br). Zeitschrift fuer Physikalische Chemie, Abteilung B: Chemie der Elementarprozesse, Aufbau der Materie 40 (1938) 146-150
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011315.cif $ #-------------------------------------------------------------------...
7,015,169
11.897
0.001
13.2519
0.0012
15.2286
0.0018
64.537
0.003
73.91
0.006
76.324
0.004
2,063.7
0.4
150
2
150
2
null
null
null
null
5
P -1
-P 1
2
- C42 H29 Cl4 N9 Zn2 -
- C42 H29 Cl4 N9 Zn2 -
- C84 H58 Cl8 N18 Zn4 -
2
1
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang
New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts.
Dalton transactions (Cambridge, England : 2003)
2,011
40
13
3365
3380
10.1039/c0dt01308k
x-ray
0.71073
MoKα
0.0711
0.0506
null
null
0.1431
0.1517
null
null
null
null
null
1.096
null
null
has coordinates
Li, Lidong; Gomes, Clara S. B.; Gomes, Pedro T.; Duarte, M. Teresa; Fan, Zhiqiang New tetradentate N,N,N,N-chelating α-diimine ligands and their corresponding zinc and nickel complexes: synthesis, characterisation and testing as olefin polymerisation catalysts. Dalton transactions (Cambridge, England : 2003) 40(13) (20...
179,855
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2016-03-25 13:38:46 +0200 (Fri, 25 Mar 2016) $ #$Revision: 179855 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/7/01/51/7015169.cif $ #-------------------------------------------------------------------...
1,011,316
4.4
null
4.4
null
4.4
null
90
null
90
null
90
null
85.2
null
null
null
null
null
null
null
null
null
synthetic
2
F m -3 m
-F 4 2 3
225
Titanium(III) nitride
Osbornite
- N Ti -
- N Ti -
- N4 Ti4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011316.cif $ #-------------------------------------------------------------------...
1,011,317
4.44
null
4.44
null
4.44
null
90
null
90
null
90
null
87.5
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Scandium(III) nitride
- N Sc -
- N Sc -
- N4 Sc4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011317.cif $ #-------------------------------------------------------------------...
1,011,318
4.28
null
4.28
null
4.28
null
90
null
90
null
90
null
78.4
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Vanadium(III) nitride
Uakitite
- N V -
- N V -
- N4 V4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
282,068
2023-03-26
10:11:44
#------------------------------------------------------------------------------ #$Date: 2023-03-26 11:09:57 +0300 (Sun, 26 Mar 2023) $ #$Revision: 282068 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011318.cif $ #-------------------------------------------------------------------...
1,011,319
4.41
null
4.41
null
4.41
null
90
null
90
null
90
null
85.8
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Niobium(III) nitride
- N Nb -
- N Nb -
- N4 Nb4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
130,149
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $ #$Revision: 130149 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011319.cif $ #-------------------------------------------------------------------...
1,011,320
4.6
null
4.6
null
4.6
null
90
null
90
null
90
null
97.3
null
null
null
null
null
null
null
null
null
synthetic
2
F m -3 m
-F 4 2 3
225
Titanium carbide
Khamrabaevite
- C Ti -
- C Ti -
- C4 Ti4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011320.cif $ #-------------------------------------------------------------------...
1,011,321
4.3
null
4.3
null
4.3
null
90
null
90
null
90
null
79.5
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Vanadium(IV) carbide
- C V -
- C V -
- C4 V4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011321.cif $ #-------------------------------------------------------------------...
1,011,322
4.76
null
4.76
null
4.76
null
90
null
90
null
90
null
107.9
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Zirconium carbide
- C Zr -
- C Zr -
- C4 Zr4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011322.cif $ #-------------------------------------------------------------------...
1,011,323
4.4
null
4.4
null
4.4
null
90
null
90
null
90
null
85.2
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Niobium carbide (1/1)
- C Nb -
- C Nb -
- C4 Nb4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011323.cif $ #-------------------------------------------------------------------...
1,011,324
4.49
null
4.49
null
4.49
null
90
null
90
null
90
null
90.5
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Tantalum(IV) carbide
- C Ta -
- C Ta -
- C4 Ta4 -
4
0.020833
Becker, K; Ebert, F
Die Kristallstrukturen einiger binaerer Carbide und Nitride.
Zeitschrift fuer Physik
1,925
31
268
272
10.1007/BF02980580
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Becker, K; Ebert, F Die Kristallstrukturen einiger binaerer Carbide und Nitride. Zeitschrift fuer Physik 31 (1925) 268-272
278,158
2022-09-26
15:28:11
#------------------------------------------------------------------------------ #$Date: 2022-09-25 22:10:12 +0300 (Sun, 25 Sep 2022) $ #$Revision: 278158 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011324.cif $ #-------------------------------------------------------------------...
1,011,325
3.796
null
3.796
null
3.796
null
90
null
90
null
90
null
54.7
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Beryllium oxide
- Be O -
- Be O -
- Be4 O4 -
4
0.020833
Gerlach, W
Die Gitterstruktur der Erdalkalioxyde.
Zeitschrift fuer Physik
1,922
9
184
192
10.1007/BF01326966
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Gerlach, W Die Gitterstruktur der Erdalkalioxyde. Zeitschrift fuer Physik 9 (1922) 184-192
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011325.cif $ #-------------------------------------------------------------------...
1,011,326
4.22
0.02
4.22
0.02
4.22
0.02
90
null
90
null
90
null
75.2
null
null
null
null
null
null
null
null
null
synthetic
2
F m -3 m
-F 4 2 3
225
Magnesium oxide
Periclase
- Mg O -
- Mg O -
- Mg4 O4 -
4
0.020833
Gerlach, W
Die Gitterstruktur der Erdalkalioxyde
Zeitschrift fuer Physik
1,922
9
184
192
10.1007/BF01326966
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Gerlach, W Die Gitterstruktur der Erdalkalioxyde Zeitschrift fuer Physik 9 (1922) 184-192
201,954
2020-10-21
18:00:00
#------------------------------------------------------------------------------ #$Date: 2017-10-13 02:32:00 +0300 (Fri, 13 Oct 2017) $ #$Revision: 201954 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011326.cif $ #-------------------------------------------------------------------...
1,011,327
4.778
0.05
4.778
0.05
4.778
0.05
90
null
90
null
90
null
109.1
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Calcium oxide
Lime
- Ca O -
- Ca O -
- Ca4 O4 -
4
0.020833
Gerlach, W
Die Gitterstruktur der Erdalkalioxyde.
Zeitschrift fuer Physik
1,922
9
184
192
10.1007/BF01326966
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Gerlach, W Die Gitterstruktur der Erdalkalioxyde. Zeitschrift fuer Physik 9 (1922) 184-192
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011327.cif $ #-------------------------------------------------------------------...
1,011,328
5.104
0.01
5.104
0.01
5.104
0.01
90
null
90
null
90
null
133
null
null
null
null
null
null
null
null
null
2
F m -3 m
-F 4 2 3
225
Strontium oxide
- O Sr -
- O Sr -
- O4 Sr4 -
4
0.020833
Gerlach, W
Die Gitterstruktur der Erdalkalioxyde.
Zeitschrift fuer Physik
1,922
9
184
192
10.1007/BF01326966
null
null
null
null
null
null
null
null
null
null
null
null
null
null
null
has coordinates
Gerlach, W Die Gitterstruktur der Erdalkalioxyde. Zeitschrift fuer Physik 9 (1922) 184-192
301,772
2025-08-18
12:31:57
#------------------------------------------------------------------------------ #$Date: 2025-08-18 15:29:48 +0300 (Mon, 18 Aug 2025) $ #$Revision: 301772 $ #$URL: file:///home/coder/svn-repositories/_RELOADED_COD/cod-reloaded/cif/1/01/13/1011328.cif $ #-------------------------------------------------------------------...