American Mineralogist Crystal Structure Database

20 matching records for this search.

Metatorbernite
Download hom/metatorbernite.pdf
Ross M, Evans H T, Appleman D E
Download am/vol49/AM49_1603.pdf
American Mineralogist 49 (1964) 1603-1621
Studies of the torbernite minerals (II): The crystal structure of
meta-torbernite
_database_code_amcsd 0000133
6.969 6.969 17.306 90 90 90 P4/n
atom     x     y     z Biso
P1     .25   .75     0   .1
P2     .25   .75    .5   .1
Cu     .25   .25 .8099  1.1
U1     .25   .25 .0510  .76
U2     .25   .25 .5524  .63
O1     .25   .25 .1564  1.6
O2     .25   .25 .6563  1.2
O3     .25   .25 .9488   .7
O4     .25   .25 .4403  1.5
O5   .7834 .0802 .4466  1.6
O6   .7038 .0818 .9486   .4
Wat7 .3476 .9814 .3105  2.7
Wat8 .2225 .9768 .8095  2.6
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Margaritasite
Download hom/margaritasite.pdf
Appleman D E, Evans H T
Download am/vol50/AM50_825.pdf
American Mineralogist 50 (1965) 825-842
The crystal structures of synthetic anhydrous carnotite, K2(UO2)2V2O8, and
its cesium analogue, Cs2(UO2)2V2O8
_database_code_amcsd 0000135
10.51 8.45 7.32 90 106.08 90 P2_1/a
atom     x     y     z Biso
Cs   .6358 .7681 .4576 1.46
U    .6813 .4795 .9873  .20
V    .9440 .6495 .8959  .02
O1   .6238 .4382 .7415 1.28
O2   .7406 .5226 .2330  .91
O3   .5098 .6525 .9667  .22
O4   .9347 .6342 .6603 1.42
O5   .8953 .4424 .9820  .63
O6   .7786 .7077 .9418  .75
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Reedmergnerite
Download hom/reedmergnerite.pdf
Appleman D E, Clark J R
Download am/vol50/AM50_1827.pdf
American Mineralogist 50 (1965) 1827-1850
Crystal structure of reedmergnerite, a boron albite, and its relation to
feldspar crystal chemistry
_database_code_amcsd 0000139
7.833 12.360 6.803 93.308 116.352 92.055 C-1
atom     x     y     z Biso
Na   .2586 .0075 .1332 1.22
B1o  .0127 .1617 .2217  .38
Si1m .0059 .8100 .2097  .28
Si2o .7029 .1015 .3204  .31
Si2m .6847 .8644 .3547  .31
OA1  .0076 .1364 .0040  .56
OA2  .5929 .9812 .2758  .55
OBo  .8455 .0995 .2126  .70
OBm  .8163 .8347 .2335  .71
OCo  .0064 .2762 .2725  .66
OCm  .0289 .6799 .2070  .74
ODo  .1900 .1200 .3815  .66
ODm  .1922 .8682 .4172  .63
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Pigeonite
Download hom/pigeonite.pdf
Clark J R, Ross M, Appleman D E
Download am/vol56/AM56_888.pdf
American Mineralogist 56 (1971) 888-908
Crystal chemistry of a lunar pigeonite
class b data refinement
_database_code_amcsd 0000248
9.678 8.905 5.227 90 108.71 90 P2_1/c
atom     x     y     z occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Mg1  .2506 .6548 .2300 .67  .55
Fe1  .2506 .6548 .2300 .33  .55
Mg2  .2564 .0167 .2246 .41  .51  .0017  .0018  .0038  .0003  .0006  .0004
Fe2  .2564 .0167 .2246 .59  .51  .0017  .0018  .0038  .0003  .0006  .0004
SiA  .0434 .3399 .2844      .40
SiB  .5520 .8364 .2368      .34
O1A  .8684 .3373 .1740      .57
O1B  .3755 .8357 .1296      .43
O2A  .1231 .4977 .3312      .78
O2B  .6314 .9850 .3814      .59
O3A  .1048 .2683 .5917     1.12  .0022  .0054  .0095  .0000  .0016  .0033
O3B  .6045 .7047 .4707     1.05  .0022  .0044  .0110  .0007  .0022  .0026
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Hulsite
Download hom/hulsite.pdf
Konnert J A, Appleman D E, Clark J R, Finger L W, Kato T, Miura Y
Download am/vol61/AM61_116.pdf
American Mineralogist 61 (1976) 116-122
Crystal structure and cation distribution of hulsite, a tin-iron borate
_database_code_amcsd 0000497
10.695 3.102 5.432 90 94.2 90 P2/m
atom     x  y     z occ Biso
Sn       0 .0     0 .20  .14
Fe1      0 .0     0 .27  .14
Fe2     .5 .0    .5 .50  .11
Fe3     .5 .0     0 .50  .21
Fe4      0 .5    .5 .36  .11
Mg4      0 .5    .5 .16  .11
Fe5  .2747 .5 .2187 .50  .17
Mg5  .2747 .5 .2187 .48  .17
B1    .241  0  .711      .18
O1    .112  0  .697      .42
O2    .305  0  .502      .59
O3    .305  0  .943      .30
O4    .091 .5  .187      .37
O5    .469 .5  .246      .32
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Laffittite
Download hom/laffittite.pdf
Nakai I, Appleman D E
Download am/vol68/AM68_235.pdf
American Mineralogist 68 (1983) 235-244
Laffittite, AgHgAsS3: crystal structure and second occurrence from the
Getchell mine, Nevada
_database_code_amcsd 0000889
7.732 11.285 6.643 90 115.16 90 Aa
atom     x     y     z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ag     .25 .0221     0 0.0291 0.0390 0.0326 0.0092 0.0152 -.0047
Hg   .7891 .3166 .0249 0.0303 0.0280 0.0292 -.0046 0.0165 0.0052
As   .2874 .3523 .0195 0.0137 0.0175 0.0162 -.0045 0.0079 -.0139
S1   .4214 .0089 .4318 0.0197 0.0168 0.0171 0.0006 0.0128 0.0000
S2   .9828 .2841 .4697 0.0178 0.0185 0.0116 -.0011 0.0073 -.0001
S3   .4369 .3722 .3947 0.0214 0.0235 0.0109 -.0030 0.0093 0.0024
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Becquerelite
Download hom/becquerelite.pdf
Pagoaga M K, Appleman D E, Stewart J M
Download am/vol72/AM72_1230.pdf
American Mineralogist 72 (1987) 1230-1238
Crystal structures and crystal chemistry of the uranyl oxide hydrates
becquerelite, billietite, and protasite
Locality: Shaba, Zaire
_database_code_amcsd 0001132
13.8378 12.3781 14.9238 90 90 90 Pn2_1a
atom       x     y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1    .08927 .5587 .25794       .0066  .0024  .0021 -.0011 -.0005 -.0013
U2    .12835 .2467 .24753       .0080  .0077  .0036  .0005  .0003 -.0001
U3    .09471 .9402 .25081       .0041  .0127  .0030 -.0015  .0007 -.0017
U4    .37304   .75 .27802       .0061  .0052  .0026 -.0006 -.0005 -.0027
U5    .34222 .4404 .29160       .0042  .0110  .0040 -.0010 -.0014 -.0022
U6    .34898 .0690 .28840       .0068  .0034  .0028 -.0027  .0006 -.0022
Ca     .0429 .5735  .5341        .021   .022   .007  -.001  -.002   .004
O101u   .053  .537  .3728 .004
O102u   .138  .590  .1414 .004
O201u  .0739  .225  .3603 .004
O202u  .1747  .260  .1352 .004
O301u  .0641  .978  .3618 .004
O302u  .1081  .914  .1368 .004
O401u  .3861  .756  .3960 .004
O402u  .3488  .763  .1583 .004
O501u   .340  .452  .4059 .004
O502u   .354  .417  .1736 .004
O601u   .333  .050  .4095 .004
O602u   .375  .099  .1686 .004
O1h     .014  .384   .204 .015
O2o     .178  .416   .287 .015
O3o    -.072  .583   .224 .015
O4h     .052  .738  .2767 .015
O5h     .245  .617   .304 .015
O7w     .112  .389   .510 .017
O8w    -.121  .579   .477 .017
O9w     .057  .754  .4755 .017
O10w    .227  .607   .504 .017
O11h    .309  .248  .3159 .015
O12h    .011  .112   .191 .015
O13o    .190  .068   .262 .015
O14o    .438  .923   .267 .015
O15h    .247  .873   .307 .015
O16w    .305  .230   .504  .02
O17w    .063  .089   .025  .02
O19w    .469  .894   .517  .02
O20w    .213  .871   .495  .02
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Billietite
Download hom/billietite.pdf
Pagoaga M K, Appleman D E, Stewart J M
Download am/vol72/AM72_1230.pdf
American Mineralogist 72 (1987) 1230-1238
Crystal structures and crystal chemistry of the uranyl oxide hydrates
becquerelite, billietite, and protasite
Note: y-coordinate of O601u atom changed to make calculated bond lengths
match those published
Locality: Shinkolobwe mine, Shaba, Zaire
_database_code_amcsd 0001133
12.0720 30.167 7.1455 90 90 90 Pbn2_1
atom       x       y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1    .44426  .25322  .0045       .0044  .0023  .0030  .0011 -.0004  .0011
U2    .25251  .26419  .4376       .0064  .0039  .0051 -.0006  .0023  .0001
U3    .06112  .25716  .0075       .0057  .0019  .0029 -.0002 -.0011 -.0018
U4    .43954 -.00465 -.0141       .0058  .0059  .0039  .0006 -.0001 -.0003
U5    .06074 -.00560 -.0081       .0053  .0062  .0034 -.0001 -.0007  .0003
U6    .25071 -.01161  .5291       .0044  .0039  .0067  .0001  .0009  .0006
Ba     .3628  .12391 -.3120       .0133  .0113  .0161 -.0006  .0006  .0019
O101u   .468   .3084   .026 .006
O102u   .416   .1949  -.004 .006
O201u   .255   .3248   .423 .006
O202u   .255   .2046   .460 .006
O301u   .031   .3116   .023 .006
O302u   .075   .1997  -.007 .006
O401u   .387   .0519  -.031 .006
O402u   .494  -.0633  -.021 .006
O501u   .109   .0504   .041 .006
O502u   .014  -.0626  -.050 .006
O601u   .258   .0449   .438 .006
O602u   .240  -.0672   .561 .006
O1h     .391   .2682   .703  .01
O2o     .411   .2520   .349 .004
O3o     .095   .2479   .309 .004
O4h     .118   .2698   .691  .01
O5h     .270   .2571   .017  .01
O11o    .418  -.0144   .676 .004
O12h    .394  -.0268   .326  .01
O13h    .104  -.0275   .326  .01
O14o    .090  -.0051   .695 .004
O15h    .252  -.0259  -.082  .01
O16w    .230   .1221  -.008 .007
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Protasite
Download hom/protasite.pdf
Pagoaga M K, Appleman D E, Stewart J M
Download am/vol72/AM72_1230.pdf
American Mineralogist 72 (1987) 1230-1238
Crystal structures and crystal chemistry of the uranyl oxide hydrates
becquerelite, billietite, and protasite
Locality: Shinkolobwe mine, Shaba, Zaire
_database_code_amcsd 0001134
12.2949 7.2206 6.9558 90 90.401 90 Pn
atom       x       y      z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
U1         0 -.02314      0       .0056  .0060  .0001 -.0002  .0006  .0002
U2    .81983 -.01959 .45837       .0027  .0059  .0026 -.0005 -.0002  .0019
U3    .11859 -.01512 .52145       .0032  .0057  .0008 -.0004 -.0013 -.0001
Ba    .97749  .51175  .3285       .0130  .0062  .0088  .0010 -.0007  .0009
O101u  .0170   -.278  -.027 .012
O102u  .9897    .231   .056 .012
O201u  .8096   -.267   .504 .012
O202u  .8418    .224   .399 .012
O301u  .1337   -.264   .558 .012
O302u  .1034    .233   .462 .012
O1o    .9794   -.092   .318 .008
O2o    .9540    .005  -.308 .008
O3h    .8086   -.074   .072 .011
O4h    .1938   -.072   .203 .011
O5o    .1505    .025  -.163 .008
O6w     .187    .545   .156  .04
O7w     .802    .534   .062  .04
O8w     .934    .442   .722  .04
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Chalcophanite
Download hom/chalcophanite.pdf
Post J E, Appleman D E
Download am/vol73/AM73_1401.pdf
American Mineralogist 73 (1988) 1401-1404
Chalcophanite, ZnMn3O7.3(H2O): New crystal-structure determinations
Locality: Bisbee, Arizona
Note: U(1,2) of O3 altered to match symmetry constraints
Note: H positions determined by energy modelling
_database_code_amcsd 0001204
7.533 7.533 20.794 90 90 120 R-3
atom      x      y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn   .71869 .57771 .99948  .0057  .0058  .0090  .0029  .0002  .0001
Zn        0      0 .09997  .0100  .0100  .0117  .0050      0      0
O1   .52784 .62297 .04721  .0098  .0083  .0080  .0050  .0000 -.0005
O2   .26077 .20655 .05048  .0097  .0095  .0122  .0055  .0028  .0026
O3        0      0 .71250  .0093  .0093  .0063 .00465      0      0
O4   .17900 .93107 .16435  .0152  .0182  .0160  .0073 -.0028  .0004
H1     .229   .025   .198
H2     .310   .940   .144
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Chalcophanite
Download hom/chalcophanite.pdf
Post J E, Appleman D E
Download am/vol73/AM73_1401.pdf
American Mineralogist 73 (1988) 1401-1404
Chalcophanite, ZnMn3O7.3(H2O): New crystal-structure determinations
Locality: Sterling Hill, New Jersey
Note: U(1,2) of O3 altered to match symmetry constraints
_database_code_amcsd 0001205
7.541 7.541 20.824 90 90 120 R-3
atom      x      y      z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3)  U(2,3)
Mn   .71873 .57764 .99951  .0052  .0055  .0065  .0028  .0000 -.00001
Zn        0      0 .09995  .0102  .0102  .0099  .0051      0       0
O1   .52817 .62287 .04701  .0094  .0065  .0076  .0041  .0007  -.0003
O2   .26021 .20621 .05036  .0098  .0087  .0089  .0054  .0012  -.0008
O3        0      0 .71224  .0095  .0095  .0063 .00475      0       0
Wat4 .17910 .92996 .16463  .0169  .0166  .0128  .0069  -.0019  .0007
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Lithiophorite
Download hom/lithiophorite.pdf
Post J E, Appleman D E
Download am/vol79/AM79_370.pdf
American Mineralogist 79 (1994) 370-374
Crystal structure refinement of lithiophorite
Note: U(1,2) for Mn/Al/Li/O2 have been altered to match symmetry constraints.
_database_code_amcsd 0001641
2.9247 2.9247 28.169 90 90 120 R-3m
atom   x   y     z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mn     0   0     0           .0131  .0131  .0158 .00655      0      0
Al   1/3 2/3   1/6 .65       .0073  .0073  .0128 .00365      0      0
Li   1/3 2/3   1/6 .33       .0073  .0073  .0128 .00365      0      0
O1   2/3 1/3 .0343           .0224  .0224  .0182  .0112      0      0
O2   2/3 1/3 .1319           .0217  .0217  .0129 .01085      0      0
H    2/3 1/3  .099      .12
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Minehillite
Download hom/minehillite.pdf
Dai Y S, Post J E, Appleman D E
Download am/vol80/AM80_173.pdf
American Mineralogist 80 (1995) 173-178
Crystal structure of minehillite: Twinning and structural relationships to
reyerite
_database_code_amcsd 0001716
9.777 9.777 33.293 90 90 120 P-3c1
atom      x       y      z  occ  Uiso
K         0       0    .25 .948 .0231
Zn        0  .49431    .25 .802 .0098
Al      1/3     2/3 .25112      .0080
Ca1     1/3     2/3 .11288      .0098
Ca2  .91036  .38794 .11169      .0100
Ca3  .75653 -.05187 .09618      .0113
Si1     2/3     1/3 .03155      .0074
Si2   .7581   .1246 .18744      .0076
Si3   .8727   .2386 .31193      .0071
Si4   .8934   .2080 .02173      .0079
Oh1       0       0  .1229       .015
O2      2/3     1/3  .0793      .0107
Oh3   .1000   .6077 .07794      .0121
O4    .7246  -.0516 .19881      .0129
O5    .5871  -.2682 .14137      .0122
O6    .1729   .5100 .21832      .0104
O7    .2949   .0565 .19824      .0155
O8    .5135   .3478 .21654      .0106
O9    .4103   .2746 .14053      .0118
O10   .2600   .2371 .01397      .0134
O11   .5035   .1897 .01354      .0135
O12   .2654   .0464 .06664      .0136
H1        0       0   .141        .02
H2     .115    .610   .059        .02
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Tridymite
Download hom/tridymite.pdf
Konnert J H, Appleman D E
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=34&spage=391
Acta Crystallographica B34 (1978) 391-403
The crystal structure of low tridymite
Locality: Plumas County, California, USA
_database_code_amcsd 0009625
9.932 17.216 81.864 90.0 90.0 90.0 F1
atom        x       y      z Biso
Si11   .06049  .03633 .03414  .61
Si12   .56126  .03679 .03371  .61
Si13  -.02022  .19793 .01846  .61
Si14   .23025  .28978 .02831  .61
Si15   .48204  .19712 .01779  .61
Si16   .72606  .29128 .02822  .61
Si17   .31136  .46063 .01895  .61
Si18   .81084  .46158 .01933  .61
Si21   .01300  .05235 .07211  .61
Si22   .48576  .03038 .07135  .61
Si23  -.01645  .22688 .07960  .61
Si24   .23070  .31107 .06598  .61
Si25   .46080  .20317 .07936  .61
Si26   .71072  .28419 .06591  .61
Si27   .25859  .46761 .08318  .61
Si28   .73949  .44146 .08340  .61
Si31   .05429  .04645 .12921  .61
Si32   .55652  .04513 .12951  .61
Si33  -.02557  .21178 .11701  .61
Si34   .22884  .28380 .13270  .61
Si35   .48158  .21099 .11717  .61
Si36   .72795  .28732 .13375  .61
Si37   .30672  .45008 .12047  .61
Si38   .80469  .45095 .12077  .61
Si41  -.00806  .05747 .16665  .61
Si42   .51258  .03123 .16666  .61
Si43  -.03431  .21530 .18369  .61
Si44   .24039  .27072 .17021  .61
Si45   .48592  .18696 .18403  .61
Si46   .71198  .29733 .17140  .61
Si47   .26630  .44539 .17770  .61
Si48   .73858  .47061 .17894  .61
Si51   .04792  .03540 .23125  .61
Si52   .54997  .03394 .23180  .61
Si53  -.03233  .20609 .22157  .61
Si54   .22078  .30081 .23164  .61
Si55   .46402  .20260 .22158  .61
Si56   .71696  .29734 .23155  .61
Si57   .29700  .46113 .21579  .61
Si58   .79829  .45915 .21663  .61
Si61  -.00500  .03156 .26833  .61
Si62   .49360  .02861 .26878  .61
Si63  -.07624  .20251 .27784  .61
Si64   .17311  .29695 .26892  .61
Si65   .42106  .20037 .27810  .61
Si66   .67164  .29420 .26879  .61
Si67   .24310  .45700 .28464  .61
Si68   .74099  .45386 .28401  .61
Si71  -.01127  .05741 .33366  .61
Si72   .51099  .03461 .33274  .61
Si73  -.03549  .21523 .31602  .61
Si74   .23592  .27164 .33012  .61
Si75   .48141  .19216 .31597  .61
Si76   .71254  .29525 .32940  .61
Si77   .26507  .44681 .32239  .61
Si78   .73711  .46883 .32151  .61
Si81   .05402  .04624 .37071  .61
Si82   .55433  .04489 .37002  .61
Si83  -.02367  .20997 .38348  .61
Si84   .22606  .28414 .36728  .61
Si85   .47769  .20929 .38290  .61
Si86   .72917  .28317 .36679  .61
Si87   .30406  .44985 .37919  .61
Si88   .80457  .44962 .37903  .61
Si91   .01089  .04822 .42801  .61
Si92   .49177  .02779 .42869  .61
Si93  -.01648  .22402 .42095  .61
Si94   .23522  .30330 .43401  .61
Si95   .46602  .20096 .42080  .61
Si96   .71384  .28565 .43382  .61
Si97   .26175  .45878 .41648  .61
Si98   .74321  .44246 .41648  .61
Si101  .00089  .03822 .46580  .61
Si102  .50365  .03917 .46628  .61
Si103 -.06794  .19996 .48037  .61
Si104  .18252  .29559 .47201  .61
Si105  .43200  .20000 .48127  .61
Si106  .68040  .29548 .47172  .61
Si107  .25501  .46482 .48221  .61
Si108  .75445  .46519 .48184  .61
O121   .02331  .02880 .05321
O122   .53202  .03557 .05282
O123   .18855  .30450 .04704
O124   .68116  .30149 .04695
O231  -.06621  .22910 .09828
O232   .45120  .22872 .09819
O233   .28736  .43393 .10126
O234   .78692  .42769 .10194
O341   .03987  .06824 .14807
O342   .53585  .06510 .14851
O343   .19016  .26991 .15158
O344   .69419  .27038 .15271
O451  -.06233  .19435 .20250
O452   .43292  .18790 .20259
O453   .27472  .47082 .19647
O454   .79075  .46998 .19732
O561   .03607  .00890 .24997
O562   .54753  .00924 .25073
O563   .20233  .32513 .25050
O564   .69557  .32268 .25029
O671  -.06081  .19694 .29712
O672   .43250  .19703 .29745
O673   .28913  .46581 .30342
O674   .78507  .46136 .30288
O781   .03549  .07231 .35209
O782   .54098  .06541 .35093
O783   .18331  .26704 .34864
O784   .69788  .26518 .34786
O891  -.06560  .22485 .40227
O892   .44709  .22556 .40200
O893   .28665  .42878 .39814
O894   .79172  .43183 .39803
O1091  .02675  .02229 .44667
O1092  .53965  .02918 .44729
O1093  .19695  .30664 .45287
O1094  .68300  .30920 .45242
O1011 -.05068  .17436 .49912
O1012  .45126  .17230 .49990
O1013  .28663  .48885 .50083
O1014  .78581  .48869 .50049
O11   -.03453 -.02233 .02397
O12    .21504  .01065 .03152
O13    .46516 -.02383 .02440
O14    .71548  .00966 .03108
O15    .03828  .12458 .02849
O16    .54350  .12344 .02711
O17   -.15552  .22774 .02709
O18    .09752  .26258 .01843
O19    .34720  .22544 .02695
O110   .59632  .26374 .01782
O111   .28313  .36924 .02027
O112   .77913  .37097 .02058
O21   -.13521  .03536 .07910
O22    .12074  .00451 .08279
O23    .36614 -.03305 .07245
O24    .60971  .00404 .08268
O25    .04317  .14369 .07451
O26    .42613  .11183 .07778
O27   -.13907  .25131 .06786
O28    .10255  .29035 .07728
O29    .35300  .25204 .06899
O210   .60949  .21645 .07209
O211   .27766  .39862 .07004
O212   .68080  .36035 .07652
O31   -.03956 -.02582 .12417
O32    .20800  .02253 .12546
O33    .45876 -.02388 .12378
O34    .71016  .01902 .12657
O35    .01672  .12187 .11855
O36    .53102  .12274 .11909
O37   -.15153  .23020 .12863
O38    .09963  .26688 .12146
O39    .34668  .22426 .12767
O310   .59670  .27066 .12288
O311   .27857  .37158 .13039
O312   .77435  .37635 .13196
O41   -.12477 -.00657 .16729
O42    .11944  .03418 .17769
O43    .36308 -.00436 .16748
O44    .61930 -.03701 .17025
O45   -.06677  .13958 .17288
O46    .53602  .10036 .17960
O47   -.13692  .28276 .17792
O48    .11713  .24625 .18189
O49    .36134  .20851 .17220
O410   .60790  .24769 .18233
O411   .29727  .35425 .17561
O412   .67902  .38824 .17331
O51   -.04879 -.01691 .21988
O52    .20109  .02038 .22560
O53    .45224 -.02256 .22162
O54    .70138  .02185 .22520
O55    .01610  .12601 .22966
O56    .50938  .12330 .23024
O57   -.16976  .23072 .23071
O58    .07875  .27201 .22448
O59    .32898  .23136 .23066
O510   .57759  .26756 .22387
O511   .26947  .37294 .22080
O512   .76357  .37077 .22090
O61   -.13495 -.01919 .27293
O62    .11728  .01166 .28050
O63    .36767 -.02723 .27257
O64    .61405  .01162 .28149
O65   -.04016  .12214 .26904
O66    .44879  .11770 .26981
O67   -.23071  .22311 .27351
O68    .01841  .26978 .27030
O69    .26732  .22413 .27369
O610   .51778  .26532 .27027
O611   .20067  .36812 .28124
O612   .69288  .36573 .28107
O71   -.13170 -.00455 .33348
O72    .11483  .03043 .32267
O73    .36017  .00074 .33242
O74    .61297 -.03472 .32792
O75   -.06702  .13839 .32644
O76    .53016  .10446 .31991
O77   -.13852  .28144 .32215
O78    .11564  .24608 .31821
O79    .35817  .21043 .32810
O710   .60566  .25037 .31821
O711   .29305  .35586 .32543
O712   .68387  .38747 .32871
O81   -.04270 -.02487 .37553
O82    .20763  .01843 .37297
O83    .45804 -.02593 .37506
O84    .70792  .01982 .37353
O85    .02510  .12080 .38207
O86    .52151  .12008 .38091
O87   -.15424  .22357 .37223
O88    .09630  .26815 .37864
O89    .34475  .22541 .37221
O810   .59553  .26715 .37730
O811   .27131  .37337 .36860
O812   .77472  .37183 .36876
O91   -.13518  .02894 .42062
O92    .12484  .00585 .41725
O93    .37026 -.03506 .42775
O94    .61250 -.00547 .41758
O95    .03729  .14034 .42652
O96    .43439  .10910 .42224
O97   -.13450  .25449 .43264
O98    .10837  .28407 .42256
O99    .35841  .24435 .43203
O910   .61450  .21651 .42794
O911   .28704  .38952 .42918
O912   .68536  .35960 .42246
O101  -.11012 -.02326 .47172
O102   .13973  .02249 .47529
O103   .38978 -.02228 .47128
O104   .64061  .02355 .47609
O105  -.04298  .12673 .46855
O106   .45817  .12756 .46933
O107  -.22182  .22704 .47767
O108   .02843  .27144 .47573
O109   .27839  .22882 .47931
O1010  .52864  .27213 .47694
O1011  .20922  .37595 .48142
O1012  .71419  .37524 .48105
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Pigeonite
Download hom/pigeonite.pdf
Morimoto N, Appleman D E, Evans H T
Download zk/vol114/ZK114_120.pdf
Zeitschrift fur Kristallographie 114 (1960) 120-147
The crystal structures of clinoenstatite and pigeonite
Locality: Asio Mine, Japan
_database_code_amcsd 0010588
9.731 8.953 5.256 90 71.45 90 P2_1/c
atom    x    y     z occ  Biso
Ca1  .246 .981  .231  .2   .98
Fe1  .246 .981  .231  .8   .98
Fe2  .251 .344  .236 .32  .855
Mg2  .251 .344  .236 .68  .855
Si1  .453 .661  .274       .62
Si2  .049 .662  .252      .765
O1A  .372 .168  .315      1.17
O1B  .127 .166  .161      .595
O2A  .378 .506  .323      .885
O2B  .125 .508  .147     1.085
O3A  .395 .773  .070       .51
O3B  .108 .782 -.006       .47
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Clinoenstatite
Download hom/clinoenstatite.pdf
Morimoto N, Appleman D E, Evans H T
Download zk/vol114/ZK114_120.pdf
Zeitschrift fur Kristallographie 114 (1960) 120-147
The crystal structures of clinoenstatite and pigeonite
Locality: Bishopville, South Carolina meteorite, heat-treated
_database_code_amcsd 0010589
9.620 8.825 5.188 90 71.67 90 P2_1/c
atom    x    y    z Biso
Mg2  .247 .347 .220 .225
Mg1  .242 .986 .193  .25
Si1  .457 .658 .294  .33
Si2  .053 .661 .264 .475
O1A  .362 .156 .320  .61
O1B  .124 .159 .112 .855
O2A  .377 .498 .298 1.61
O2B  .137 .518 .103 .665
O3A  .395 .775 .101  .70
O3B  .105 .813 .051  .40
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Vayrynenite
Download hom/vayrynenite.pdf
Mrose M E, Appleman D E
Download zk/vol117/ZK117_16.pdf
Zeitschrift fur Kristallographie 117 (1962) 16-36
The crystal structures and crystal chemistry of vayrynenite,
(Mn,Fe)Be(PO4)(OH), and euclase, AlBe(SiO4)(OH)
Locality: the Viitaniemi pegmatite in the parish of Erajarvi in central Finland
_database_code_amcsd 0010590
5.411 14.49 4.730 90 102.75 90 P2_1/a
atom    x     y    z occ Biso
Mn   .248 .4390 .940 .85  .51
Fe   .248 .4390 .940 .15  .51
Be   .431 .2640 .783      .65
P    .195 .1045 .539      .23
O1   .366 .0401 .753      .59
O2   .463 .3662 .654      .39
O3   .346 .1932 .506      .46
O4   .106 .0600 .245      .59
OH   .212 .2765 .969      .74
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Euclase
Download hom/euclase.pdf
Mrose M E, Appleman D E
Download zk/vol117/ZK117_16.pdf
Zeitschrift fur Kristallographie 117 (1962) 16-36
The crystal structures and crystal chemistry of vayrynenite,
(Mn,Fe)Be(PO4)(OH), and euclase, AlBe(SiO4)(OH)
Locality: Villa Rica, Minas Gerais, Brazil
_database_code_amcsd 0010591
4.763 14.29 4.618 90 100.25 90 P2_1/a
atom    x     y    z Biso
Al   .249 .4447 .957  .10
Be   .176 .3000 .470  .46
Si   .177 .1002 .539  .06
O1   .380 .0321 .761  .18
O2   .380 .3767 .650  .21
O3   .346 .2000 .520  .20
O4   .100 .0529 .215  .27
OH   .158 .3324 .118  .42
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Gerstleyite
Download hom/gerstleyite.pdf
Nakai I, Appleman D E
 
Chemistry Letters 1981 (1981) 1327-1330
The crystal structure of gerstleyite Na2(Sb,As)8S13*2H2O:
the first sulfosalt mineral of sodium
Locality: Baker mine, Kern County, Boron, California, USA
_database_code_amcsd 0012197
9.911 23.05 7.097 90 127.85 90 Cm
atom     x     y     z occ Biso
Na   .0103 .4255 .0224     4.40
Sb1  .4128 .4059 .7933 .83 1.77
As1  .4128 .4059 .7933 .17 1.77
Sb2  .0859 .1685 .5034 .98 1.51
As2  .0859 .1685 .5034 .02 1.51
Sb3  .4846 .1690 .5155 .91 1.41
As3  .4846 .1690 .5155 .09 1.41
Sb4  .4935 .2461 .9829 .88 1.64
As4  .4935 .2461 .9829 .12 1.64
S1       0     0     0     2.32
S2   .4681 .4261 .5159     2.46
S3   .2621 .1050 .4541     2.03
S4   .1107 .4246 .5248     3.08
S5   .2890 .1746 .9451     1.56
S6   .1605 .3286 .9551     2.38
S7   .3152 .2756 .5757     1.69
Wat1  .342     0  .986     5.09
Wat2  .159    .5  .981     3.39
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Bracewellite
Download hom/bracewellite.pdf
Milton C, Appleman D E, Appleman M H, Chao E C T, Cuttita F,
Dinnin J I, Dwornik E J, Ingram B L, Rose H J
 
U.S. Geological Survey Professional Paper 887 (1976) 1-29
Merumite, a complex assemblage of chromium minerals from Guyana
Locality: Guyana
_database_code_amcsd 0015707
4.492 9.860 2.974 90 90 90 Pbnm
atom     x     y   z
Cr   -.052  .145 .25
O1    .301 -.197 .25
OH2  -.198 -.054 .25
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Total number of retrieved datasets: 20
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