American Mineralogist Crystal Structure Database

5 matching records for this search.

Cd2Na2P6O18.14H2O
 
Averbuch-Pouchot M T
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=10
Acta Crystallographica C46 (1990) 10-13
Crystal chemistry of cyclo-hexaphosphates. V. structure of cadmium
sodium cyclo-hexaphosphate tetradecahydrate
_database_code_amcsd 0010086
7.709 11.028 9.231 108.25 110.06 79.77 P-1
atom       x       y       z occ  Biso
Na1        0      .5      .5      2.26
Na   -.40959  .39358 -.36685  .5 1.700
Cd   -.40959  .39358 -.36685  .5 1.700
Cd1        0       0       0     1.272
P1   -.15104 -.19810  .14057     1.072
P2   -.04156  .20697 -.46901     1.231
P3   -.29220  .07088  .23180     1.057
OE11   .2407   .3167   .8917      1.68
OE12   .0769   .1831  -.0181      1.48
OL13   .3007   .0808   .8205      1.31
OL12  -.0159   .1754   .6959      1.43
OE21   .1526   .6678   .4698      2.05
OE22   .1379   .1887   .4980      2.03
OL23   .8332   .0916   .4148      1.68
OE31   .1899   .8905   .8565      1.58
OE32   .5179   .1308   .2210      1.78
OW1    .6284   .3279   .0486      2.44
OW2    .5350   .1945   .6327      3.17
OW3    .2193   .5607   .1080      2.75
OW4    .6952   .5446   .3075      2.31
OW5    .7568   .9819   .7602      1.95
OW6    .4231   .3831   .3631      2.70
OW7    .9488   .5980   .7600  .5  2.36
OW8    .0721   .3402   .2854  .5  2.53
H1W1    .682    .263    .069         3
H2W1    .540    .319    .010         3
H1W2    .397    .860    .317         2
H2W2    .553    .822    .392         3
H1W3    .775    .514    .950         3
H2W3    .761    .399    .932         2
H1W4    .685    .483    .244         2
H2W4    .287    .400    .723       2.2
H1W5    .216    .071    .323       2.4
H2W5    .313    .053    .231         2
H1W6    .469    .308    .313         3
H2W6    .327    .374    .342         4
HW7      .98    .531     .80  .5     3
HW78    .958    .680    .825         3
HW8      .91    .717    .677  .5     2
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Mn2(NH4)4(P6O18)(C2O4).6H2O
 
Averbuch-Pouchot M T, Durif A
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=965
Acta Crystallographica C46 (1990) 965-968
Crystal chemistry of cyclo-hexaphosphates. IX. structure of tetraammonium
dimanganese cyclo-hexaphosphate oxalate hexahydrate
_database_code_amcsd 0010138
9.747 9.751 7.689 99.92 105.88 100.08 P-1
atom      x       y      z  Biso
Mn   .84208  .11847 .70887 1.190
P1   .17081  .40931 .37697  1.09
P2   .63293 -.21426  .6301  1.19
P3   .37492 -.35663  .3171  1.20
OE11  .0394   .4170  .2285  1.68
OE12  .1536   .3809  .5538  1.83
OL12  .7575   .7064  .7169  1.48
OL13  .7060   .4459  .5685  1.73
OE21  .7029  -.0871  .5761  2.05
OE22  .5459  -.1985  .7583  2.24
OL23  .5419  -.3315  .4408  1.52
OE31  .3591  -.4438  .1318  2.04
OE32  .3339  -.2169  .3301  2.28
O1    .0348   .0210  .7936  1.69
O2    .1451   .9156  .0101  1.84
Wat1  .9075   .1655  .4750  2.09
Wat2 -.0020   .6739  .1387  1.92
Wat3  .5653   .9481  .1881  5.34
N1    .3020   .2850  .8798  2.36
N2    .7216   .2989  .1666  2.71
C     .9476   .0192  .0564  1.27
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Ca2Li2P6O18.8H2O
 
Averbuch-Pouchot M T, Durif A
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=968
Acta Crystallographica C46 (1990) 968-970
Crystal chemistry of cyclo-hexaphosphates. X. structure of dicalcium
dilithium cyclo-hexaphosphate octahydrate
_database_code_amcsd 0010140
7.767 10.144 7.225 105.17 102.76 84.95 P-1
atom      x      y      z Biso
Ca   .19038 .24157 .82356 .917
Li1      .5     .5      0  2.3
Li2       0      0      0  2.2
P1   .79668 .47973 .75598 .925
P2   .53968 .27179 .59329 .935
P3   .19655 .25937 .32919 .919
OE11  .7039  .5607  .9110 1.21
OE12  .9500  .3905  .8071 2.00
OL12  .6550  .3918  .5794 1.24
OL13  .1489  .4205  .3593 1.43
OE21  .4453  .3260  .7572 1.36
OE22  .6468  .1434  .5855 1.74
OL23  .4082  .2561  .3850 1.42
OE31  .1456  .1883  .1183 1.27
OE32  .1234  .2134  .4743 1.37
Wat1  .6183 -.0415  .2172 1.90
Wat2  .0203  .9436  .2759 1.50
Wat3  .2784  .6130  .8194 2.78
Wat4  .2539  .8918  .9822 2.16
H1W1   .376  -.006   .666  2.9
H2W1   .354  -.007   .839  2.5
H1W2   .032   .027   .353  2.9
H2W2   .115   .909   .303  2.9
H1W3   .290   .596   .711  2.3
H2W3   .203   .578   .805    5
H1W4   .259   .807   .929  2.9
H2W4   .322   .914   .085    4
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Ca2(NH4)2P6O18.6H2O
 
Averbuch-Pouchot M T
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=2005
Acta Crystallographica C46 (1990) 2005-2007
Crystal chemistry of cyclo-hexaphosphates. XII. structure of ammonium calcium
cyclo-hexaphosphate hexahydrate
_database_code_amcsd 0010197
12.821 12.537 7.029 90 90 90 P2_12_12_1
atom      x      y     z Biso
Ca   .17488 .24882 .1593  .97
P1   .15055 .15864 .6741 1.01
P2   .82400 .01642 .9398 1.01
P3   .95109 .20767 .8658  .99
N1        0      0  .354  2.6
N2       .5      0 -.012  3.5
OE11  .8259  .8364 .4684 1.67
OE12  .7925  .7731 .8109 1.47
OL12  .1599  .0363 .7345 1.72
OL13  .5271  .3244 .3062 1.61
O221  .1606  .0647 .0910 1.48
O222  .2269  .4205 .0618 1.80
OL23  .9232  .0935 .9527 1.65
O231  .8564  .2555 .7788 1.47
O232  .0097  .2670 .0117 1.55
Wat1  .4374  .8673 .6504 2.60
Wat2  .3906  .2859 .6161  4.6
Wat3  .8551  .5199 .6632  6.0
H1N1   .543   .467   .69    5
H2N1   .537   .578   .60    3
H1N2   .939   .481   .95    4
H2N2   .002   .446   .06    4
H1W1   .563   .099   .53    4
H2W1   .530   .188   .65    4
H1W2   .156   .773   .30    4
H2W2   .872   .226   .52    4
H1W3   .627   .062   .40    5
H2W3   .311   .934   .24    5
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(NH3OH)6P6O18.4H2O
 
Durif A, Averbuch-Pouchot M T
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-2701&volume=46&spage=2026
Acta Crystallographica C46 (1990) 2026-2028
Crystal chemistry of cyclo-hexaphosphates. VIII. structure of hydroxylammonium
cyclo-hexaphosphate tetrahydrate
_database_code_amcsd 0010206
10.365 9.278 7.280 108.39 100.30 96.02 P-1
atom      x      y      z  Biso
P1   .28199 .49585 .39028 1.103
P2   .40646 .76239 .73136  .995
P3   .30424 .17000 .22317 1.004
OL12 .39626 .58996  .5839  1.63
OL13 .29873 .32754  .3920  1.40
OE11 .15037  .5286  .4293  1.72
OE12 .31926  .5197  .2119  1.78
OE21 .37873 .86386  .6122  1.60
OE22 .66977  .2377  .1145  1.78
OL23 .55982 .79580  .8421  1.28
OE31 .31287 .05327  .3234  1.62
OE32 .19463  .1420  .0484  1.78
N1    .5208  .1704  .7353  1.65
O1    .5450  .7016  .2345  2.25
N2    .0896  .8220  .4192  1.77
O2    .1267  .8206  .2420  2.45
N3    .9068  .4123  .1395  1.73
O3    .8804  .5498  .1089  2.63
Wat1  .1757  .1324  .6666  2.06
Wat2  .9599  .1501  .2108  2.45
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View JMOL 3-D Structure (permalink)
 
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Total number of retrieved datasets: 5
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