American Mineralogist Crystal Structure Database

52 matching records for this search.

Fluor-liddicoatite
 
Ertl A, Hughes J M, Prowatke S, Ludwig T, Prasad P S R, Brandstatter F,
Korner W, Schuster R, Pertlik F, Marschall H
Download am/vol91/AM91_1847.pdf
American Mineralogist 91 (2006) 1847-1856
Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite
series from Madagascar: Structure, chemistry, and infrared spectroscopic studies
Locality: Anjanabonoina, Madagascar
Sample: LID3NEW
_database_code_amcsd 0004246
15.8322 15.8322 7.1034 90 90 120 R3m
atom        x        y       z occ   Uiso
CaX         0        0     .75 .57  .0069
NaX         0        0     .75 .29  .0069
AlY   -.12340  -.06170   .3518 .47  .0104
LiY   -.12340  -.06170   .3518 .44  .0104
Mn2+Y -.12340  -.06170   .3518 .02  .0104
AlZ   -.29675  -.25965  .37670     .00810
SiT   -.19203  -.19009 -.01194 .98 .00557
BT    -.19203  -.19009 -.01194 .02 .00557
B     -.10891  -.21782  -.4668      .0082
F1W         0        0   .2026 .76  .0365
O1W         0        0   .2026 .24  .0365
O2    -.05989  -.11978  -.4938      .0191
O3V   -.26830  -.13415   .4783      .0129
O4    -.09253  -.18506  -.0866      .0106
O5    -.18439 -.092145  -.1081      .0109
O6    -.19564  -.18583   .2123      .0097
O7    -.28612  -.28547 -.09272     .00845
O8    -.20964  -.27022  -.4530      .0098
H1W    -.0552   -.0276    .151 .08   .000
H3V     -.267   -.1335   -.419       .041
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Ertl A, Hughes J M, Prowatke S, Ludwig T, Prasad P S R, Brandstatter F,
Korner W, Schuster R, Pertlik F, Marschall H
Download am/vol91/AM91_1847.pdf
American Mineralogist 91 (2006) 1847-1856
Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite
series from Madagascar: Structure, chemistry, and infrared spectroscopic studies
Locality: Anjanabonoina, Madagascar
Sample: LID6A1
_database_code_amcsd 0004247
15.8204 15.8204 7.0955 90 90 120 R3m
atom       x       y       z  occ   Uiso
CaX        0       0     .25  .50  .0093
NaX        0       0     .25  .34  .0093
AlY   .12266  .06133  -.3470  .52  .0104
LiY   .12266  .06133  -.3470  .38  .0104
Fe2+Y .12266  .06133  -.3470  .02  .0104
Mn2+Y .12266  .06133  -.3470  .01  .0104
AlZ   .29675  .25979 -.37409      .00827
SiT   .19196  .19000  .01538  .96 .00611
BT    .19196  .19000  .01538  .04 .00611
B     .10895  .21790   .4698       .0082
F1W        0       0  -.2009  .56  .0325
O1W        0       0  -.2009  .44  .0325
O2    .05996  .11992   .4991       .0188
O3V   .26689 .133445  -.4759       .0138
O4    .09279  .18558   .0900       .0112
O5    .18494  .09247   .1115       .0117
O6    .19538  .18539  -.2093      .00974
O7    .28627  .28561  .09517      .00873
O8    .20955  .27011  .45548      .00982
H1W    .0538   .0269   -.145 .147   .000
H3V     .263   .1315    .413        .049
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Ertl A, Hughes J M, Prowatke S, Ludwig T, Prasad P S R, Brandstatter F,
Korner W, Schuster R, Pertlik F, Marschall H
Download am/vol91/AM91_1847.pdf
American Mineralogist 91 (2006) 1847-1856
Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite
series from Madagascar: Structure, chemistry, and infrared spectroscopic studies
Locality: Anjanabonoina, Madagascar
Sample: LID52
_database_code_amcsd 0004248
15.8119 15.8119 7.0925 90 90 120 R3m
atom       x      y       z  occ   Uiso
CaX        0      0     .25  .41  .0110
NaX        0      0     .25  .41  .0110
AlY   .12240 .06120 -.34536  .54  .0102
LiY   .12240 .06120 -.34536  .36  .0102
Mn2+Y .12240 .06120 -.34536  .01  .0102
Fe2+Y .12240 .06120 -.34536  .01  .0102
AlZ   .29674 .25991 -.37294      .00815
SiT   .19188 .18990  .01696  .95 .00605
BT    .19188 .18990  .01696  .05 .00605
B     .10895 .21790   .4713       .0083
F1W        0      0  -.2006  .51  .0303
O1W        0      0  -.2006  .49  .0303
O2    .05999 .11998   .5022       .0183
O3V   .26596 .13298  -.4746       .0138
O4    .09304 .18608   .0913       .0113
O5    .18534 .09267   .1129       .0118
O6    .19522 .18508 -.20791      .00971
O7    .28630 .28569  .09613      .00872
O8    .20954 .27009  .45660      .00976
H1W    .0543 .02715   -.146 .163   .000
H3V     .263  .1315    .418        .052
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L1, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018406
15.8636 15.8636 7.1119 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76231 .487  .0161
NaX         0      0 .76231 .435  .0161
PbX         0      0 .76231 .022  .0161
AlY    .06192 .93808 .36906 .413  .0113
FeY    .06192 .93808 .36906 .037  .0113
MnY    .06192 .93808 .36906 .121  .0113
LiY    .06192 .93808 .36906 .429  .0113
TiY    .06192 .93808 .36906 .001  .0113
AlZ    .26015 .29717 .38793      .00617
SiT    .19025 .19213      0      .00496
B      .89084 .10916  .5448       .0064
F(1o)       0      0  .2117 .709  .0566
OH(1o)      0      0  .2117 .291  .0566
O(2o)  .93974 .06026  .5202       .0171
O(3)   .13483 .86517  .4897       .0100
O(4)   .90771 .09229  .9269       .0080
O(5)   .09234 .90766  .9054       .0082
O(6)   .18672 .19640 .22361       .0074
O(7)   .28551 .28578 .91842       .0063
O(8)   .27012 .20968 .55784       .0075
H(3)    .1337  .8663   .624        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L1, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018407
15.8636 15.8636 7.1119 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76231 .487  .0161
NaX         0      0 .76231 .435  .0161
PbX         0      0 .76231 .022  .0161
TiY    .06192 .93808 .36906 .001  .0113
AlY    .06192 .93808 .36906 .413  .0113
FeY    .06192 .93808 .36906 .037  .0113
MnY    .06192 .93808 .36906 .121  .0113
LiY    .06192 .93808 .36906 .429  .0113
AlZ    .26015 .29717 .38793      .00617
SiT    .19025 .19213      0      .00496
B      .89084 .10916  .5448       .0064
F(1d)  .01155  .0231  .2115 .236  .0149
OH(1d) .01155  .0231  .2115 .097  .0149
O(2d)   .9302  .0508  .5200   .5  .0087
O(3)   .13483 .86517  .4897       .0100
O(4)   .90771 .09229  .9269       .0080
O(5)   .09234 .90766  .9054       .0082
O(6)   .18672 .19640 .22361       .0074
O(7)   .28551 .28578 .91842       .0063
O(8)   .27012 .20968 .55784       .0075
H(3)    .1337  .8663   .624        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L2, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018408
15.8529 15.8529 7.1101 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76028 .563  .0157
NaX         0      0 .76028 .354  .0157
PbX         0      0 .76028 .026  .0157
AlY    .06195 .93805 .36814 .398  .0117
FeY    .06195 .93805 .36814 .005  .0117
MnY    .06195 .93805 .36814  .11  .0117
LiY    .06195 .93805 .36814 .487  .0117
AlZ    .25992 .29700 .38782      .00640
SiT    .19020 .19215      0      .00507
B      .89089 .10911  .5451       .0068
F(1o)       0      0  .2120 .694  .0554
OH(1o)      0      0  .2120 .306  .0554
O(2o)  .93998 .06002  .5199       .0183
O(3)   .13490 .86510  .4893       .0102
O(4)   .90773 .09227  .9263       .0081
O(5)   .09213 .90787  .9047       .0086
O(6)   .18644 .19624 .22358       .0074
O(7)   .28547 .28581 .91820       .0063
O(8)   .27016 .20953 .55771       .0077
H(3)     .130   .870  .6256        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L2, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018409
15.8529 15.8529 7.1101 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76028 .563  .0157
NaX         0      0 .76028 .354  .0157
PbX         0      0 .76028 .026  .0157
AlY    .06195 .93805 .36814 .398  .0117
FeY    .06195 .93805 .36814 .005  .0117
MnY    .06195 .93805 .36814  .11  .0117
LiY    .06195 .93805 .36814 .487  .0117
AlZ    .25992 .29700 .38782      .00640
SiT    .19020 .19215      0      .00507
B      .89089 .10911  .5451       .0068
F(1d)  .01152  .0230  .2118 .231   .014
OH(1d) .01152  .0230  .2118 .102   .014
O(2d)   .9304  .0505  .5197   .5  .0102
O(3)   .13490 .86510  .4893       .0102
O(4)   .90773 .09227  .9263       .0081
O(5)   .09213 .90787  .9047       .0086
O(6)   .18644 .19624 .22358       .0074
O(7)   .28547 .28581 .91820       .0063
O(8)   .27016 .20953 .55771       .0077
H(3)     .130   .870  .6256        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L4, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018410
15.8548 15.8548 7.1099 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76060 .517  .0165
NaX         0      0 .76060 .386  .0165
PbX         0      0 .76060 .021  .0165
TiY    .06191 .93809 .36813 .001  .0114
AlY    .06191 .93809 .36813 .391  .0114
FeY    .06191 .93809 .36813  .03  .0114
MgY    .06191 .93809 .36813 .034  .0114
MnY    .06191 .93809 .36813 .078  .0114
LiY    .06191 .93809 .36813 .465  .0114
AlZ    .26002 .29703 .38784      .00647
SiT    .19018 .19210      0      .00515
B      .89101 .10899  .5448       .0072
F(1o)       0      0  .2126 .589  .0537
OH(1o)      0      0  .2126 .411  .0537
O(2o)  .93983 .06017  .5197       .0162
O(3)   .13478 .86522  .4895       .0101
O(4)   .90773 .09227  .9265       .0082
O(5)   .09226 .90774  .9048       .0090
O(6)   .18634 .19616 .22358       .0074
O(7)   .28554 .28588 .91854       .0064
O(8)   .27019 .20964 .55767       .0076
H(3)    .1303  .8697   .625        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L4, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018411
15.8548 15.8548 7.1099 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76060 .517  .0165
NaX         0      0 .76060 .386  .0165
PbX         0      0 .76060 .021  .0165
TiY    .06191 .93809 .36813 .001  .0114
AlY    .06191 .93809 .36813 .391  .0114
FeY    .06191 .93809 .36813  .03  .0114
MgY    .06191 .93809 .36813 .034  .0114
MnY    .06191 .93809 .36813 .078  .0114
LiY    .06191 .93809 .36813 .465  .0114
AlZ    .26002 .29703 .38784      .00647
SiT    .19018 .19210      0      .00515
B      .89101 .10899  .5448       .0072
F(1d)  .01134  .0227  .2125 .196  .0144
OH(1d) .01134  .0227  .2125 .137  .0144
O(2d)   .9308  .0511  .5195   .5  .0088
O(3)   .13478 .86522  .4895       .0101
O(4)   .90773 .09227  .9265       .0082
O(5)   .09226 .90774  .9048       .0090
O(6)   .18634 .19616 .22358       .0074
O(7)   .28554 .28588 .91854       .0064
O(8)   .27019 .20964 .55767       .0076
H(3)    .1303  .8697   .625        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L5, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018412
15.8456 15.8456 7.1066 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76011 .628  .0143
NaX         0      0 .76011 .297  .0143
PbX         0      0 .76011 .023  .0143
AlY    .06192 .93808 .36673 .396  .0117
FeY    .06192 .93808 .36673 .007  .0117
MnY    .06192 .93808 .36673 .069  .0117
LiY    .06192 .93808 .36673 .528  .0117
AlZ    .25977 .29691 .38791      .00637
SiT    .19025 .19215      0      .00511
B      .89099 .10901  .5446       .0075
F(1o)       0      0  .2121 .702  .0551
OH(1o)      0      0  .2121 .298  .0551
O(2o)  .93986 .06014  .5198       .0167
O(3)   .13478 .86522  .4895       .0104
O(4)   .90781 .09219  .9255       .0087
O(5)   .09217 .90783  .9041       .0082
O(6)   .18640 .19590 .22349       .0071
O(7)   .28537 .28589 .91828       .0064
O(8)   .27004 .20972 .55772       .0075
H(3)    .1321  .8679   .623        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L5, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018413
15.8456 15.8456 7.1066 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76011 .628  .0143
NaX         0      0 .76011 .297  .0143
PbX         0      0 .76011 .023  .0143
AlY    .06192 .93808 .36673 .396  .0117
FeY    .06192 .93808 .36673 .007  .0117
MnY    .06192 .93808 .36673 .069  .0117
LiY    .06192 .93808 .36673 .528  .0117
AlZ    .25977 .29691 .38791      .00637
SiT    .19025 .19215      0      .00511
B      .89099 .10901  .5446       .0075
F(1d)  .01136  .0227  .2119 .234  .0151
OH(1d) .01136  .0227  .2119  .99  .0151
O(2d)   .9305  .0509  .5196   .5  .0088
O(3)   .13478 .86522  .4895       .0104
O(4)   .90781 .09219  .9255       .0087
O(5)   .09217 .90783  .9041       .0082
O(6)   .18640 .19590 .22349       .0071
O(7)   .28537 .28589 .91828       .0064
O(8)   .27004 .20972 .55772       .0075
H(3)    .1321  .8679   .623        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L6, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018414
15.8418 15.8418 7.1044 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76028 .641  .0145
NaX         0      0 .76028 .288  .0145
PbX         0      0 .76028 .023  .0145
AlY    .06188 .93812 .36596 .398  .0124
FeY    .06188 .93812 .36596 .007  .0124
MnY    .06188 .93812 .36596  .06  .0124
LiY    .06188 .93812 .36596 .535  .0124
AlZ    .25972 .29686 .38801      .00633
SiT    .19023 .19212      0      .00500
B      .89104 .10896  .5447       .0068
F(1o)       0      0  .2115 .696  .0540
OH(1o)      0      0  .2115 .304  .0540
O(2o)  .93990 .06010  .5198       .0171
O(3)   .13493 .86507  .4899       .0103
O(4)   .90780 .09220  .9256       .0084
O(5)   .09210 .90790  .9042       .0085
O(6)   .18632 .19597 .22365       .0071
O(7)   .28534 .28596 .91837       .0064
O(8)   .27000 .20969 .55794       .0076
H(3)    .1306  .8694   .622        .015
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L6, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018415
15.8418 15.8418 7.1044 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76028 .641  .0145
NaX         0      0 .76028 .288  .0145
PbX         0      0 .76028 .023  .0145
AlY    .06188 .93812 .36596 .398  .0124
FeY    .06188 .93812 .36596 .007  .0124
MnY    .06188 .93812 .36596  .06  .0124
LiY    .06188 .93812 .36596 .535  .0124
AlZ    .25972 .29686 .38801      .00633
SiT    .19023 .19212      0      .00500
B      .89104 .10896  .5447       .0068
F(1d)  .01128  .0226  .2114 .232  .0145
OH(1d) .01128  .0226  .2114 .101  .0145
O(2d)   .9306  .0509  .5196   .5  .0092
O(3)   .13493 .86507  .4899       .0103
O(4)   .90780 .09220  .9256       .0084
O(5)   .09210 .90790  .9042       .0085
O(6)   .18632 .19597 .22365       .0071
O(7)   .28534 .28596 .91837       .0064
O(8)   .27000 .20969 .55794       .0076
H(3)    .1306  .8694   .622        .015
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L7, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018416
15.8363 15.8363 7.1040 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76057 .636  .0144
NaX         0      0 .76057 .282  .0144
PbX         0      0 .76057  .02  .0144
TiY    .06185 .93815 .36575 .001  .0113
AlY    .06185 .93815 .36575 .408  .0113
FeY    .06185 .93815 .36575 .015  .0113
MgY    .06185 .93815 .36575 .001  .0113
MnY    .06185 .93815 .36575 .045  .0113
LiY    .06185 .93815 .36575 .531  .0113
AlZ    .25973 .29683 .38801      .00640
SiT    .19017 .19210      0      .00518
B      .89115 .10885  .5444       .0069
F(1o)       0      0  .2118 .709  .0522
OH(1o)      0      0  .2118 .291  .0522
O(2o)  .94001 .05999  .5199       .0169
O(3)   .13484 .86516  .4896       .0104
O(4)   .90786 .09214  .9257       .0085
O(5)   .09203 .90797  .9042       .0084
O(6)   .18607 .19593 .22357       .0071
O(7)   .28541 .28596 .91831       .0065
O(8)   .26996 .20947 .55779       .0074
H(3)    .1279  .8721   .620        .015
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L7, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018417
15.8363 15.8363 7.1040 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76057 .636  .0144
NaX         0      0 .76057 .282  .0144
PbX         0      0 .76057  .02  .0144
TiY    .06185 .93815 .36575 .001  .0113
AlY    .06185 .93815 .36575 .408  .0113
FeY    .06185 .93815 .36575 .015  .0113
MgY    .06185 .93815 .36575 .001  .0113
MnY    .06185 .93815 .36575 .045  .0113
LiY    .06185 .93815 .36575 .531  .0113
AlZ    .25973 .29683 .38801      .00640
SiT    .19017 .19210      0      .00518
B      .89115 .10885  .5444       .0069
F(1d)  .01111  .0222  .2117 .236   .014
OH(1d) .01111  .0222  .2117 .097   .014
O(2d)   .9309  .0510  .5197   .5  .0095
O(3)   .13484 .86516  .4896       .0104
O(4)   .90786 .09214  .9257       .0085
O(5)   .09203 .90797  .9042       .0084
O(6)   .18607 .19593 .22357       .0071
O(7)   .28541 .28596 .91831       .0065
O(8)   .26996 .20947 .55779       .0074
H(3)    .1279  .8721   .620        .015
Download AMC data (View Text File)
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L11, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018418
15.8675 15.8675 7.1135 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76038 .441  .0173
NaX         0      0 .76038 .471  .0173
PbX         0      0 .76038 .025  .0173
AlY    .06200 .93800 .37036 .389  .0108
FeY    .06200 .93800 .37036 .009  .0108
MnY    .06200 .93800 .37036 .177  .0108
LiY    .06200 .93800 .37036 .426  .0108
AlZ    .26026 .29728 .38757      .00609
SiT    .19021 .19214      0      .00493
B      .89067 .10933  .5451       .0069
F(1o)       0      0  .2114 .681  .0612
OH(1o)      0      0  .2114 .319  .0612
O(2o)  .93960 .06040  .5209       .0180
O(3)   .13504 .86496  .4894       .0091
O(4)   .90755 .09245  .9268       .0078
O(5)   .09244 .90756  .9053       .0081
O(6)   .18694 .19657 .22355       .0073
O(7)   .28546 .28565 .91811       .0062
O(8)   .27017 .20974 .55749       .0076
H(3)    .1319  .8681   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L11, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018419
15.8675 15.8675 7.1135 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76038 .441  .0173
NaX         0      0 .76038 .471  .0173
PbX         0      0 .76038 .025  .0173
AlY    .06200 .93800 .37036 .389  .0108
FeY    .06200 .93800 .37036 .009  .0108
MnY    .06200 .93800 .37036 .177  .0108
LiY    .06200 .93800 .37036 .426  .0108
AlZ    .26026 .29728 .38757      .00609
SiT    .19021 .19214      0      .00493
B      .89067 .10933  .5451       .0069
F(1d)  .01214  .0243  .2112 .227   .014
OH(1d) .01214  .0243  .2112 .106   .014
O(2d)   .9298  .0507  .5207   .5  .0090
O(3)   .13504 .86496  .4894       .0091
O(4)   .90755 .09245  .9268       .0078
O(5)   .09244 .90756  .9053       .0081
O(6)   .18694 .19657 .22355       .0073
O(7)   .28546 .28565 .91811       .0062
O(8)   .27017 .20974 .55749       .0076
H(3)    .1319  .8681   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L12, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018420
15.853 15.853 7.120 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76015  .51 .01604
NaX         0      0 .76015 .408 .01604
PbX         0      0 .76015 .026 .01604
AlY    .06192 .93808 .36940 .397  .0115
FeY    .06192 .93808 .36940 .009  .0115
MnY    .06192 .93808 .36940 .141  .0115
LiY    .06192 .93808 .36940 .453  .0115
AlZ    .26009 .29709 .38774      .00653
SiT    .19020 .19212      0      .00518
B      .89096 .10904  .5454       .0069
F(1o)       0      0  .2113 .752  .0549
OH(1o)      0      0  .2113 .248 .0549
O(2o)  .93979 .06021  .5203       .0176
O(3)   .13492 .86508  .4894       .0102
O(4)   .90767 .09233  .9268       .0085
O(5)   .09227 .90773  .9051       .0088
O(6)   .18674 .19646 .22354       .0073
O(7)   .28551 .28579 .91824       .0064
O(8)   .27016 .20967 .55772       .0082
H(3)    .1311  .8689   .624        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L12, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018421
15.853 15.853 7.120 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76015  .51 .01604
NaX         0      0 .76015 .408 .01604
PbX         0      0 .76015 .026 .01604
AlY    .06192 .93808 .36940 .397  .0115
FeY    .06192 .93808 .36940 .009  .0115
MnY    .06192 .93808 .36940 .141  .0115
LiY    .06192 .93808 .36940 .453  .0115
AlZ    .26009 .29709 .38774      .00653
SiT    .19020 .19212      0      .00518
B      .89096 .10904  .5454       .0069
F(1d)  .01165  .0233  .2111 .251   .012
OH(1d) .01165  .0233  .2111 .082   .012
O(2d)   .9300  .0505  .5202   .5  .0088
O(3)   .13492 .86508  .4894       .0102
O(4)   .90767 .09233  .9268       .0085
O(5)   .09227 .90773  .9051       .0088
O(6)   .18674 .19646 .22354       .0073
O(7)   .28551 .28579 .91824       .0064
O(8)   .27016 .20967 .55772       .0082
H(3)    .1311  .8689   .624        .015
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L13, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018422
15.8449 15.8449 7.1053 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76231 .583  .0161
NaX         0      0 .76231 .345  .0161
PbX         0      0 .76231 .006  .0161
TiY    .06196 .93804 .36590 .003  .0110
AlY    .06196 .93804 .36590 .403  .0110
FeY    .06196 .93804 .36590 .005  .0110
MgY    .06196 .93804 .36590  .02  .0110
MnY    .06196 .93804 .36590 .011  .0110
LiY    .06196 .93804 .36590 .497  .0110
AlZ    .25978 .29699 .38818      .00631
SiT    .19019 .19212      0      .00539
B      .89082 .10918  .5450       .0073
F(1o)       0      0  .2130 .647  .0546
OH(1o)      0      0  .2130 .353  .0546
O(2o)  .93980 .06020  .5191       .0167
O(3)   .13458 .86542  .4900       .0100
O(4)   .90765 .09235  .9255       .0085
O(5)   .09219 .90781  .9043       .0085
O(6)   .18640 .19593 .22381       .0073
O(7)   .28531 .28582 .91855       .0063
O(8)   .27008 .20974 .55830       .0076
H(3)   .13312  .8668   .625        .015
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L13, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018423
15.8449 15.8449 7.1053 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76231 .583  .0161
NaX         0      0 .76231 .345  .0161
PbX         0      0 .76231 .006  .0161
TiY    .06196 .93804 .36590 .003  .0110
AlY    .06196 .93804 .36590 .403  .0110
FeY    .06196 .93804 .36590 .005  .0110
MgY    .06196 .93804 .36590  .02  .0110
MnY    .06196 .93804 .36590 .011  .0110
LiY    .06196 .93804 .36590 .497  .0110
AlZ    .25978 .29699 .38818      .00631
SiT    .19019 .19212      0      .00539
B      .89082 .10918  .5450       .0073
F(1d)  .01115  .0223  .2128 .216  .0158
OH(1d) .01115  .0223  .2128 .117  .0158
O(2d)   .9306  .0511  .5190   .5  .0090
O(3)   .13458 .86542  .4900       .0100
O(4)   .90765 .09235  .9255       .0085
O(5)   .09219 .90781  .9043       .0085
O(6)   .18640 .19593 .22381       .0073
O(7)   .28531 .28582 .91855       .0063
O(8)   .27008 .20974 .55830       .0076
H(3)   .13312  .8668   .625        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L15, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018424
15.8248 15.8248 7.0993 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76133 .696  .0134
NaX         0      0 .76133 .228  .0134
PbX         0      0 .76133  .01  .0134
AlY    .06182 .93818  .3637 .419  .0113
FeY    .06182 .93818  .3637  .01  .0113
MnY    .06182 .93818  .3637 .011  .0113
LiY    .06182 .93818  .3637  .56  .0113
AlZ    .25956 .29670 .38834      .00608
SiT    .19020 .19210      0      .00509
B      .89111 .10889  .5446       .0067
F(1o)       0      0  .2116 .668  .0522
OH(1o)      0      0  .2116 .332  .0522
O(2o)  .94007 .05993  .5188       .0164
O(3)   .13465 .86535  .4902       .0105
O(4)   .90785 .09215  .9248       .0084
O(5)   .09192 .90808  .9042       .0079
O(6)   .18579 .19537  .2233       .0072
O(7)   .28522 .28582 .91856       .0063
O(8)   .26990 .20955 .55810       .0076
H(3)    .1384  .8616   .625        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L15, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018425
15.8248 15.8248 7.0993 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76133 .696  .0134
NaX         0      0 .76133 .228  .0134
PbX         0      0 .76133  .01  .0134
AlY    .06182 .93818  .3637 .419  .0113
FeY    .06182 .93818  .3637  .01  .0113
MnY    .06182 .93818  .3637 .011  .0113
LiY    .06182 .93818  .3637  .56  .0113
AlZ    .25956 .29670 .38834      .00608
SiT    .19020 .19210      0      .00509
B      .89111 .10889  .5446       .0067
F(1d)  .01091  .0218  .2114 .222  .0148
OH(1d) .01091  .0218  .2114 .111  .0148
O(2d)  .93061  .0506  .5188   .5  .0082
O(3)   .13465 .86535  .4902       .0105
O(4)   .90785 .09215  .9248       .0084
O(5)   .09192 .90808  .9042       .0079
O(6)   .18579 .19537  .2233       .0072
O(7)   .28522 .28582 .91856       .0063
O(8)   .26990 .20955 .55810       .0076
H(3)    .1384  .8616   .625        .015
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L16, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018426
15.8307 15.8307 7.1013 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76121 .685  .0142
NaX         0      0 .76121 .245  .0142
PbX         0      0 .76121  .01  .0142
TiY    .06184 .93816 .36437 .001  .0103
AlY    .06184 .93816 .36437 .429  .0103
FeY    .06184 .93816 .36437  .02  .0103
MnY    .06184 .93816 .36437 .012  .0103
LiY    .06184 .93816 .36437 .539  .0103
AlZ    .25959 .29671 .38825      .00608
SiT    .19018 .19206      0      .00493
B      .89126 .10874  .5447       .0068
F(1o)       0      0  .2117 .685  .0492
OH(1o)      0      0  .2117 .315  .0492
O(2o)  .94020 .05980  .5197       .0164
O(3)   .13462 .86538 .48995       .0107
O(4)   .90791 .09209 .92522       .0084
O(5)   .09198 .90802 .90386       .0083
O(6)   .18587 .19569 .22358      .00718
O(7)   .28539 .28599 .91839      .00602
O(8)   .26990 .20948 .55815      .00735
H(3)    .1325  .8675   .624        .015
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L16, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018427
15.8307 15.8307 7.1013 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76121 .685  .0142
NaX         0      0 .76121 .245  .0142
PbX         0      0 .76121  .01  .0142
TiY    .06184 .93816 .36437 .001  .0103
AlY    .06184 .93816 .36437 .429  .0103
FeY    .06184 .93816 .36437  .02  .0103
MnY    .06184 .93816 .36437 .012  .0103
LiY    .06184 .93816 .36437 .539  .0103
AlZ    .25959 .29671 .38825      .00608
SiT    .19018 .19206      0      .00493
B      .89126 .10874  .5447       .0068
F(1d)  .01085  .0217  .2115 .228  .0131
OH(1d) .01085  .0217  .2115 .105  .0131
O(2d)  .93127 .05097  .5194   .5  .0093
O(3)   .13462 .86538 .48995       .0107
O(4)   .90791 .09209 .92522       .0084
O(5)   .09198 .90802 .90386       .0083
O(6)   .18587 .19569 .22358      .00718
O(7)   .28539 .28599 .91839      .00602
O(8)   .26990 .20948 .55815      .00735
H(3)    .1325  .8675   .624        .015
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L17, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018428
15.8337 15.8337 7.1023 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76167 .645  .0148
NaX         0      0 .76167 .282  .0148
PbX         0      0 .76167 .009  .0148
TiY    .06183 .93817 .36458 .002  .0110
AlY    .06183 .93817 .36458 .432  .0110
FeY    .06183 .93817 .36458 .003  .0110
MnY    .06183 .93817 .36458  .01  .0110
LiY    .06183 .93817 .36458 .519  .0110
AlZ    .25965 .29678 .38821      .00616
SiT    .19020 .19211      0      .00530
B      .89120 .10880  .5444       .0071
F(1o)       0      0  .2121 .714  .0521
OH(1o)      0      0  .2121 .286  .0521
O(2o)  .94006 .05994  .5189       .0162
O(3)   .13461 .86539  .4899       .0106
O(4)   .90785 .09215  .9253       .0084
O(5)   .09199 .90801  .9039       .0088
O(6)   .18605 .19576 .22368       .0072
O(7)   .28538 .28594 .91839      .00614
O(8)   .26986 .20952 .55796       .0074
H(3)    .1320  .8680   .622        .015
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L17, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018429
15.8337 15.8337 7.1023 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76167 .645  .0148
NaX         0      0 .76167 .282  .0148
PbX         0      0 .76167 .009  .0148
TiY    .06183 .93817 .36458 .002  .0110
AlY    .06183 .93817 .36458 .432  .0110
FeY    .06183 .93817 .36458 .003  .0110
MnY    .06183 .93817 .36458  .01  .0110
LiY    .06183 .93817 .36458 .519  .0110
AlZ    .25965 .29678 .38821      .00616
SiT    .19020 .19211      0      .00530
B      .89120 .10880  .5444       .0071
F(1d)  .01108  .0222  .2120 .238   .015
OH(1d) .01108  .0222  .2120 .095   .015
O(2d)   .9311  .0511  .5187   .5  .0091
O(3)   .13461 .86539  .4899       .0106
O(4)   .90785 .09215  .9253       .0084
O(5)   .09199 .90801  .9039       .0088
O(6)   .18605 .19576 .22368       .0072
O(7)   .28538 .28594 .91839      .00614
O(8)   .26986 .20952 .55796       .0074
H(3)    .1320  .8680   .622        .015
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L18, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018430
15.8293 15.8293 7.1003 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76118 .688  .0140
NaX         0      0 .76118 .239  .0140
PbX         0      0 .76118 .009  .0140
TiY    .06182 .93818 .36366 .001  .0110
AlY    .06182 .93818 .36366 .445  .0110
FeY    .06182 .93818 .36366  .01  .0110
MnY    .06182 .93818 .36366 .011  .0110
LiY    .06182 .93818 .36366 .532  .0110
AlZ    .25957 .29670 .38821      .00626
SiT    .19018 .19211      0      .00528
B      .89123 .10877  .5444       .0069
F(1o)       0      0  .2110  .73  .0482
OH(1o)      0      0  .2110  .27  .0482
O(2o)  .94015 .05985  .5193       .0161
O(3)   .13448 .86552  .4899       .0111
O(4)   .90791 .09209  .9252       .0083
O(5)   .09197 .90803  .9037       .0085
O(6)   .18598 .19565 .22373       .0075
O(7)   .28547 .28610 .91847      .00617
O(8)   .26992 .20950 .55805       .0074
H(3)    .1294  .8706   .624        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L18, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018431
15.8293 15.8293 7.1003 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76118 .688  .0140
NaX         0      0 .76118 .239  .0140
PbX         0      0 .76118 .009  .0140
TiY    .06182 .93818 .36366 .001  .0110
AlY    .06182 .93818 .36366 .445  .0110
FeY    .06182 .93818 .36366  .01  .0110
MnY    .06182 .93818 .36366 .011  .0110
LiY    .06182 .93818 .36366 .532  .0110
AlZ    .25957 .29670 .38821      .00626
SiT    .19018 .19211      0      .00528
B      .89123 .10877  .5444       .0069
F(1d)  .01073  .0215  .2108 .243   .013
OH(1d) .01073  .0215  .2108  .09   .013
O(2d)   .9313  .0511  .5191   .5  .0092
O(3)   .13448 .86552  .4899       .0111
O(4)   .90791 .09209  .9252       .0083
O(5)   .09197 .90803  .9037       .0085
O(6)   .18598 .19565 .22373       .0075
O(7)   .28547 .28610 .91847      .00617
O(8)   .26992 .20950 .55805       .0074
H(3)    .1294  .8706   .624        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L19, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018432
15.8343 15.8343 7.1012 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76142 .682  .0141
NaX         0      0 .76142 .248  .0141
PbX         0      0 .76142 .009  .0141
TiY    .06186 .93814 .36396 .001  .0110
AlY    .06186 .93814 .36396 .432  .0110
FeY    .06186 .93814 .36396 .015  .0110
MnY    .06186 .93814 .36396 .009  .0110
LiY    .06186 .93814 .36396 .542  .0110
AlZ    .25958 .29672 .38819      .00609
SiT    .19019 .19210      0      .00509
B      .89106 .10894  .5447       .0069
F(1o)       0      0  .2115 .669  .0518
OH(1o)      0      0  .2115 .331  .0518
O(2o)  .94010 .05990  .5190       .0162
O(3)   .13455 .86545  .4899       .0105
O(4)   .90793 .09207  .9248       .0081
O(5)   .09207 .90793  .9040       .0083
O(6)   .18595 .19554 .22357       .0070
O(7)   .28524 .28589 .91828      .00618
O(8)   .26999 .20964 .55817       .0072
H(3)    .1316  .8684   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L19, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018433
15.8343 15.8343 7.1012 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76142 .682  .0141
NaX         0      0 .76142 .248  .0141
PbX         0      0 .76142 .009  .0141
TiY    .06186 .93814 .36396 .001  .0110
AlY    .06186 .93814 .36396 .432  .0110
FeY    .06186 .93814 .36396 .015  .0110
MnY    .06186 .93814 .36396 .009  .0110
LiY    .06186 .93814 .36396 .542  .0110
AlZ    .25958 .29672 .38819      .00609
SiT    .19019 .19210      0      .00509
B      .89106 .10894  .5447       .0069
F(1d)  .01096  .0219  .2114 .223   .014
OH(1d) .01096  .0219  .2114  .11   .014
O(2d)   .9311  .0510  .5190   .5  .0089
O(3)   .13455 .86545  .4899       .0105
O(4)   .90793 .09207  .9248       .0081
O(5)   .09207 .90793  .9040       .0083
O(6)   .18595 .19554 .22357       .0070
O(7)   .28524 .28589 .91828      .00618
O(8)   .26999 .20964 .55817       .0072
H(3)    .1316  .8684   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L20, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018434
15.8303 15.8303 7.1017 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76161 .691  .0136
NaX         0      0 .76161 .234  .0136
PbX         0      0 .76161 .006  .0136
TiY    .06175 .93825 .36394 .001  .0103
AlY    .06175 .93825 .36394 .436  .0103
FeY    .06175 .93825 .36394 .018  .0103
MgY    .06175 .93825 .36394 .001  .0103
MnY    .06175 .93825 .36394 .008  .0103
LiY    .06175 .93825 .36394 .537  .0103
AlZ    .25959 .29668 .38827      .00590
SiT    .19017 .19207      0      .00471
B      .89135 .10865  .5448       .0070
F(1o)       0      0  .2117 .679  .0491
OH(1o)      0      0  .2117 .321  .0491
O(2o)  .94025 .05975  .5193       .0157
O(3)   .13470 .86530  .4902       .0104
O(4)   .90792 .09208  .9252       .0077
O(5)   .09194 .90806  .9037       .0078
O(6)   .18585 .19565 .22351       .0068
O(7)   .28545 .28601 .91848       .0059
O(8)   .26981 .20944 .55806       .0069
H(3)    .1293  .8708   .624        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L20, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018435
15.8303 15.8303 7.1017 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76161 .691  .0136
NaX         0      0 .76161 .234  .0136
PbX         0      0 .76161 .006  .0136
TiY    .06175 .93825 .36394 .001  .0103
AlY    .06175 .93825 .36394 .436  .0103
FeY    .06175 .93825 .36394 .018  .0103
MgY    .06175 .93825 .36394 .001  .0103
MnY    .06175 .93825 .36394 .008  .0103
LiY    .06175 .93825 .36394 .537  .0103
AlZ    .25959 .29668 .38827      .00590
SiT    .19017 .19207      0      .00471
B      .89135 .10865  .5448       .0070
F(1d)  .01078  .0216  .2114 .226  .0138
OH(1d) .01078  .0216  .2114 .107  .0138
O(2d)   .9314  .0510  .5191   .5  .0086
O(3)   .13470 .86530  .4902       .0104
O(4)   .90792 .09208  .9252       .0077
O(5)   .09194 .90806  .9037       .0078
O(6)   .18585 .19565 .22351       .0068
O(7)   .28545 .28601 .91848       .0059
O(8)   .26981 .20944 .55806       .0069
H(3)    .1293  .8708   .624        .015
Download AMC data (View Text File)
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L21, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018436
15.8399 15.8399 7.1030 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76207 .638  .0147
NaX         0      0 .76207 .284  .0147
PbX         0      0 .76207 .006  .0147
TiY    .06183 .93817 .36477 .002  .0105
AlY    .06183 .93817 .36477 .417  .0105
FeY    .06183 .93817 .36477 .044  .0105
MgY    .06183 .93817 .36477 .005  .0105
MnY    .06183 .93817 .36477  .01  .0105
LiY    .06183 .93817 .36477 .522  .0105
AlZ    .25969 .29684 .38829      .00592
SiT    .19020 .19212      0      .00494
B      .89109 .10891  .5449       .0068
F(1o)       0      0  .2123 .668  .0535
OH(1o)      0      0  .2123 .332  .0535
O(2o)  .94008 .05992  .5195       .0168
O(3)   .13454 .86546  .4900       .0102
O(4)   .90782 .09218  .9257       .0080
O(5)   .09204 .90796  .9041       .0086
O(6)   .18617 .19579 .22380       .0071
O(7)   .28527 .28596 .91863       .0061
O(8)   .27006 .20969 .55831       .0074
H(3)    .1350  .8650   .626        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L21, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018437
15.8399 15.8399 7.1030 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76207 .638  .0147
NaX         0      0 .76207 .284  .0147
PbX         0      0 .76207 .006  .0147
TiY    .06183 .93817 .36477 .002  .0105
AlY    .06183 .93817 .36477 .417  .0105
FeY    .06183 .93817 .36477 .044  .0105
MgY    .06183 .93817 .36477 .005  .0105
MnY    .06183 .93817 .36477  .01  .0105
LiY    .06183 .93817 .36477 .522  .0105
AlZ    .25969 .29684 .38829      .00592
SiT    .19020 .19212      0      .00494
B      .89109 .10891  .5449       .0068
F(1d)  .01101  .0220  .2119 .222  .0152
OH(1d) .01101  .0220  .2119 .111  .0152
O(2d)   .9307  .0509  .5190   .5  .0089
O(3)   .13454 .86546  .4900       .0102
O(4)   .90782 .09218  .9257       .0080
O(5)   .09204 .90796  .9041       .0086
O(6)   .18617 .19579 .22380       .0071
O(7)   .28527 .28596 .91863       .0061
O(8)   .27006 .20969 .55831       .0074
H(3)    .1350  .8650   .626        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L22, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018438
15.8306 15.8306 7.0999 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0  .7613 .683  .0135
NaX         0      0  .7613 .247  .0135
PbX         0      0  .7613 .006  .0135
TiY    .06180 .93820  .3644 .001  .0093
AlY    .06180 .93820  .3644 .413  .0093
FeY    .06180 .93820  .3644 .021  .0093
MgY    .06180 .93820  .3644 .009  .0093
MnY    .06180 .93820  .3644 .012  .0093
LiY    .06180 .93820  .3644 .544  .0093
AlZ    .25963 .29673 .38811      .00570
SiT    .19025 .19212      0      .00454
B      .89128 .10872  .5457       .0066
F(1o)       0      0  .2121 .638  .0494
OH(1o)      0      0  .2121 .362  .0494
O(2o) .94016 .05984  .5198       .0167
O(3)   .13446 .86554  .4897       .0100
O(4)   .90789 .09211  .9251       .0075
O(5)   .09201 .90799  .9037       .0084
O(6)   .18584 .19559  .2238       .0066
O(7)   .28535 .28610  .9183       .0061
O(8)   .26992 .20946  .5582       .0072
H(3)    .1307  .8693   .625        .015
Download AMC data (View Text File)
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L22, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018439
15.8306 15.8306 7.0999 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0  .7613 .683  .0135
NaX         0      0  .7613 .247  .0135
PbX         0      0  .7613 .006  .0135
TiY    .06180 .93820  .3644 .001  .0093
AlY    .06180 .93820  .3644 .413  .0093
FeY    .06180 .93820  .3644 .021  .0093
MgY    .06180 .93820  .3644 .009  .0093
MnY    .06180 .93820  .3644 .012  .0093
LiY    .06180 .93820  .3644 .544  .0093
AlZ    .25963 .29673 .38811      .00570
SiT    .19025 .19212      0      .00454
B      .89128 .10872  .5457       .0066
F(1d)   .0109  .0217  .2119 .213  .0129
OH(1d)  .0109  .0217  .2119  .12  .0129
O(2d)   .9317  .0515  .5196   .5  .0103
O(3)   .13446 .86554  .4897       .0100
O(4)   .90789 .09211  .9251       .0075
O(5)   .09201 .90799  .9037       .0084
O(6)   .18584 .19559  .2238       .0066
O(7)   .28535 .28610  .9183       .0061
O(8)   .26992 .20946  .5582       .0072
H(3)    .1307  .8693   .625        .015
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L23, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018440
15.8299 15.8299 7.1009 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76143 .695  .0141
NaX         0      0 .76143  .24  .0141
PbX         0      0 .76143 .007  .0141
TiY    .06195 .93805 .36442 .001  .0104
AlY    .06195 .93805 .36442 .439  .0104
FeY    .06195 .93805 .36442 .019  .0104
MgY    .06195 .93805 .36442 .007  .0104
MnY    .06195 .93805 .36442 .011  .0104
LiY    .06195 .93805 .36442 .523  .0104
AlZ    .25958 .29670 .38819      .00602
SiT    .19019 .19212      0      .00503
B      .89117 .10883  .5447       .0068
F(1o)       0      0  .2116 .678  .0500
OH(1o)      0      0  .2116 .322  .0500
O(2o)  .94020 .05980  .5197       .0162
O(3)   .13461 .86539  .4898       .0104
O(4)   .90778 .09222  .9251       .0082
O(5)   .09197 .90803 .90347       .0083
O(6)   .18598 .19565 .22363      .00692
O(7)   .28533 .28597 .91836      .00607
O(8)   .26995 .20957 .55790      .00736
H(3)    .1308  .8692   .622        .015
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L23, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018441
15.8299 15.8299 7.1009 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76143 .695  .0141
NaX         0      0 .76143  .24  .0141
PbX         0      0 .76143 .007  .0141
TiY    .06195 .93805 .36442 .001  .0104
AlY    .06195 .93805 .36442 .439  .0104
FeY    .06195 .93805 .36442 .019  .0104
MgY    .06195 .93805 .36442 .007  .0104
MnY    .06195 .93805 .36442 .011  .0104
LiY    .06195 .93805 .36442 .523  .0104
AlZ    .25958 .29670 .38819      .00602
SiT    .19019 .19212      0      .00503
B      .89117 .10883  .5447       .0068
F(1d)  .01083  .0217  .2114 .226  .0140
OH(1d) .01083  .0217  .2114  .17  .0140
O(2d)  .93117 .05087  .5195   .5  .0088
O(3)   .13461 .86539  .4898       .0104
O(4)   .90778 .09222  .9251       .0082
O(5)   .09197 .90803 .90347       .0083
O(6)   .18598 .19565 .22363      .00692
O(7)   .28533 .28597 .91836      .00607
O(8)   .26995 .20957 .55790      .00736
H(3)    .1308  .8692   .622        .015
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L24, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018442
15.8286 15.8286 7.1012 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76087 .684  .0137
NaX         0      0 .76087 .238  .0137
PbX         0      0 .76087 .013  .0137
AlY    .06187 .93813 .36431 .431  .0110
FeY    .06187 .93813 .36431 .013  .0110
MnY    .06187 .93813 .36431 .016  .0110
LiY    .06187 .93813 .36431  .54  .0110
AlZ    .25962 .29673 .38823      .00610
SiT    .19019 .19209      0      .00501
B      .89119 .10881  .5453       .0066
F(1o)       0      0  .2118 .712  .0498
OH(1o)      0      0  .2118 .288  .0498
O(2o)  .94008 .05992  .5195       .0160
O(3)   .13465 .86535  .4900       .0103
O(4)   .90786 .09214  .9252       .0081
O(5)   .09191 .90809  .9036       .0084
O(6)   .18601 .19570 .22385       .0074
O(7)   .28541 .28595 .91837       .0062
O(8)   .26994 .20947 .55795       .0074
H(3)    .1328  .8672   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L24, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018443
15.8286 15.8286 7.1012 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76087 .684  .0137
NaX         0      0 .76087 .238  .0137
PbX         0      0 .76087 .013  .0137
AlY    .06187 .93813 .36431 .431  .0110
FeY    .06187 .93813 .36431 .013  .0110
MnY    .06187 .93813 .36431 .016  .0110
LiY    .06187 .93813 .36431  .54  .0110
AlZ    .25962 .29673 .38823      .00610
SiT    .19019 .19209      0      .00501
B      .89119 .10881  .5453       .0066
F(1d)  .01087  .0217  .2116 .237  .0136
OH(1d) .01087  .0217  .2116 .096  .0136
O(2d)   .9310  .0510  .5192   .5 .00864
O(3)   .13465 .86535  .4900       .0103
O(4)   .90786 .09214  .9252       .0081
O(5)   .09191 .90809  .9036       .0084
O(6)   .18601 .19570 .22385       .0074
O(7)   .28541 .28595 .91837       .0062
O(8)   .26994 .20947 .55795       .0074
H(3)    .1328  .8672   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L25, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018444
15.8438 15.8438 7.1043 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76157  .61  .0144
NaX         0      0 .76157 .322  .0144
PbX         0      0 .76157 .007  .0144
TiY    .06196 .93804 .36551 .002  .0098
AlY    .06196 .93804 .36551  .38  .0098
FeY    .06196 .93804 .36551  .04  .0098
MgY    .06196 .93804 .36551 .019  .0098
MnY    .06196 .93804 .36551  .02  .0098
LiY    .06196 .93804 .36551 .538  .0098
AlZ    .25973 .29684 .38806      .00601
SiT    .19018 .19211      0      .00480
B      .89103 .10897  .5447       .0065
F(1o)       0      0  .2121 .633  .0526
OH(1o)      0      0  .2121 .337  .0526
O(2o)  .94003 .05997  .5196       .0157
O(3)   .13475 .86525  .4900       .0098
O(4)   .90785 .09215  .9255       .0080
O(5)   .09202 .90798  .9040       .0079
O(6)   .18627 .19593 .22362       .0068
O(7)   .28533 .28590 .91835       .0062
O(8)   .27008 .20966 .55791       .0075
H(3)    .1316  .8684   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L25, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018445
15.8438 15.8438 7.1043 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76157  .61  .0144
NaX         0      0 .76157 .322  .0144
PbX         0      0 .76157 .007  .0144
TiY    .06196 .93804 .36551 .002  .0098
AlY    .06196 .93804 .36551  .38  .0098
FeY    .06196 .93804 .36551  .04  .0098
MgY    .06196 .93804 .36551 .019  .0098
MnY    .06196 .93804 .36551  .02  .0098
LiY    .06196 .93804 .36551 .538  .0098
AlZ    .25973 .29684 .38806      .00601
SiT    .19018 .19211      0      .00480
B      .89103 .10897  .5447       .0065
F(1d)  .01128  .0226  .2119 .211  .0125
OH(1d) .01128  .0226  .2119 .112  .0125
O(2d)   .9308  .0509  .5194   .5  .0079
O(3)   .13475 .86525  .4900       .0098
O(4)   .90785 .09215  .9255       .0080
O(5)   .09202 .90798  .9040       .0079
O(6)   .18627 .19593 .22362       .0068
O(7)   .28533 .28590 .91835       .0062
O(8)   .27008 .20966 .55791       .0075
H(3)    .1316  .8684   .623        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L26, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018446
15.8368 15.8368 7.1014 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76167  .66  .0146
NaX         0      0 .76167 .272  .0146
PbX         0      0 .76167 .005  .0146
TiY    .06181 .93819 .36473 .003  .0117
AlY    .06181 .93819 .36473 .398  .0117
FeY    .06181 .93819 .36473 .031  .0117
MnY    .06181 .93819 .36473 .017  .0117
LiY    .06181 .93819 .36473 .549  .0117
AlZ    .25973 .29686 .38801      .00606
SiT    .19014 .19207      0      .00490
B      .89129 .10871  .5444       .0061
OH(1o)      0      0  .2120 .566  .0533
F(1o)       0      0  .2120 .434  .0533
O(2o)  .94003 .05997  .5199       .0160
O(3)   .13473 .86527  .4903       .0098
O(4)   .90784 .09216  .9254       .0081
O(5)   .09199 .90801  .9040       .0085
O(6)   .18617 .19589 .22343       .0071
O(7)   .28545 .28601 .91837       .0061
O(8)   .26993 .20961 .55783       .0073
H(3)    .1272  .8728   .618        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L26, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018447
15.8368 15.8368 7.1014 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76167  .66  .0146
NaX         0      0 .76167 .272  .0146
PbX         0      0 .76167 .005  .0146
TiY    .06181 .93819 .36473 .003  .0117
AlY    .06181 .93819 .36473 .398  .0117
FeY    .06181 .93819 .36473 .031  .0117
MnY    .06181 .93819 .36473 .017  .0117
LiY    .06181 .93819 .36473 .549  .0117
AlZ    .25973 .29686 .38801      .00606
SiT    .19014 .19207      0      .00490
B      .89129 .10871  .5444       .0061
OH(1d) .01074  .0215  .2117 .189  .0037
F(1d)  .01074  .0215  .2117 .144  .0037
O(2d)   .9312  .0513  .5192   .5  .0092
O(3)   .13473 .86527  .4903       .0098
O(4)   .90784 .09216  .9254       .0081
O(5)   .09199 .90801  .9040       .0085
O(6)   .18617 .19589 .22343       .0071
O(7)   .28545 .28601 .91837       .0061
O(8)   .26993 .20961 .55783       .0073
H(3)    .1272  .8728   .618        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L27, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018448
15.8333 15.8333 7.1025 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76151 .614  .0147
NaX         0      0 .76151 .311  .0147
PbX         0      0 .76151 .006  .0147
TiY    .06183 .93817 .36530 .006  .0112
AlY    .06183 .93817 .36530 .424  .0112
FeY    .06183 .93817 .36530 .052  .0112
MgY    .06183 .93817 .36530 .006  .0112
MnY    .06183 .93817 .36530 .019  .0112
LiY    .06183 .93817 .36530 .494  .0112
AlZ    .25964 .29677 .38811      .00613
SiT    .19022 .19214      0      .00500
B      .89123 .10877  .5450       .0067
F(1o)       0      0  .2118 .633  .0501
OH(1o)      0      0  .2118 .367  .0501
O(2o)  .94003 .05997  .5198       .0159
O(3)   .13484 .86516  .4899       .0103
O(4)   .90794 .09206  .9255       .0083
O(5)   .09200 .90800  .9041       .0087
O(6)   .18609 .19576 .22360       .0068
O(7)   .28528 .28590 .91825       .0063
O(8)   .26999 .20960 .55798       .0073
H(3)    .1312  .8688   .622        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L27, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018449
15.8333 15.8333 7.1025 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76151 .614  .0147
NaX         0      0 .76151 .311  .0147
PbX         0      0 .76151 .006  .0147
TiY    .06183 .93817 .36530 .006  .0112
AlY    .06183 .93817 .36530 .424  .0112
FeY    .06183 .93817 .36530 .052  .0112
MgY    .06183 .93817 .36530 .006  .0112
MnY    .06183 .93817 .36530 .019  .0112
LiY    .06183 .93817 .36530 .494  .0112
AlZ    .25964 .29677 .38811      .00613
SiT    .19022 .19214      0      .00500
B      .89123 .10877  .5450       .0067
F(1d)  .01099  .0220  .2119 .211  .0131
OH(1d) .01099  .0220  .2119 .122  .0131
O(2d)   .9307  .0507  .5198   .5  .0080
O(3)   .13484 .86516  .4899       .0103
O(4)   .90794 .09206  .9255       .0083
O(5)   .09200 .90800  .9041       .0087
O(6)   .18609 .19576 .22360       .0068
O(7)   .28528 .28590 .91825       .0063
O(8)   .26999 .20960 .55798       .0073
H(3)    .1312  .8688   .622        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L28, ordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018450
15.8404 15.8404 7.1039 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76133  .63  .0153
NaX         0      0 .76133 .338  .0153
PbX         0      0 .76133 .007  .0153
TiY    .06210 .93790 .36663 .004  .0104
AlY    .06210 .93790 .36663 .401  .0104
FeY    .06210 .93790 .36663 .041  .0104
MgY    .06210 .93790 .36663 .023  .0104
MnY    .06210 .93790 .36663 .023  .0104
LiY    .06210 .93790 .36663 .508  .0104
AlZ    .25975 .29691 .38799      .00619
SiT    .19019 .19212      0      .00504
B      .89101 .10899  .5448       .0067
F(1o)       0      0  .2122 .691  .0534
OH(1o)      0      0  .2122 .309  .0534
O(2o)  .94000 .06000  .5199       .0160
O(3)   .13473 .86527  .4897       .0102
O(4)   .90788 .09212  .9257       .0084
O(5)   .09206 .90794  .9044       .0082
O(6)   .18633 .19591 .22364       .0071
O(7)   .28542 .28587 .91841      .00608
O(8)   .26994 .20957 .55782       .0076
H(3)    .1339  .8661   .625        .015
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Fluor-liddicoatite
 
Lussier A J, Abdu Y, Hawthorne F C, Michaelis V K, Aguiar P M, Kroeker S
 
The Canadian Mineralogist 49 (2011) 63-88
Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar.
I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy
Sample: L28, disordered model
Locality: Anjanabonoina, central Madagascar
_database_code_amcsd 0018451
15.8404 15.8404 7.1039 90 90 120 R3m
atom        x      y      z  occ   Uiso
CaX         0      0 .76133  .63  .0153
NaX         0      0 .76133 .338  .0153
PbX         0      0 .76133 .007  .0153
TiY    .06210 .93790 .36663 .004  .0104
AlY    .06210 .93790 .36663 .401  .0104
FeY    .06210 .93790 .36663 .041  .0104
MgY    .06210 .93790 .36663 .023  .0104
MnY    .06210 .93790 .36663 .023  .0104
LiY    .06210 .93790 .36663 .508  .0104
AlZ    .25975 .29691 .38799      .00619
SiT    .19019 .19212      0      .00504
B      .89101 .10899  .5448       .0067
F(1d)  .01123  .0225  .2120  .23  .0144
OH(1d) .01123  .0225  .2120 .103  .0144
O(2d)   .9309  .0510  .5198   .5  .0086
O(3)   .13473 .86527  .4897       .0102
O(4)   .90788 .09212  .9257       .0084
O(5)   .09206 .90794  .9044       .0082
O(6)   .18633 .19591 .22364       .0071
O(7)   .28542 .28587 .91841      .00608
O(8)   .26994 .20957 .55782       .0076
H(3)    .1339  .8661   .625        .015
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Fluor-liddicoatite
 
Aurisicchio C, Demartin F, Ottolini L, Pezzotta F
 
European Journal of Mineralogy 11 (1999) 237-242
Homogeneous liddicoatite from Madagascar: a possible
reference material? First EMPA, SIMS and SREF data
Sample: 1
Locality: Madagascar
_database_code_amcsd 0006766
15.880 15.880 7.118 90 90 120 R3m
atom      x      y       z  occ Biso
CaX       0      0   .2339 .483 .643
NaX       0      0   .2339 .412 .643
KX        0      0   .2339 .105 .643
LiY  .93831 .06169   .6289  2/3 .673
AlY  .93831 .06169   .6289  1/3 .673
AlZ  .29730 .26033  .61097      .466
Si   .19208 .19020 -.00105      .377
B    .10932 .89068   .4528       .56
F1    .9887  .0113   .7868 .109 1.24
O1    .9887  .0113   .7868 .127 1.24
OH1   .9887  .0113   .7868 .097 1.24
OH1   .2695 .13475   .5085       .84
O2   .06062 .93938   .4782      1.60
O3   .09253 .18506   .0719       .73
O4    .1849 .09245   .0938       .76
O5   .19663 .18679   .7751       .66
O6   .28586 .28578   .0803       .57
O7   .20966 .27029   .4409       .68
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Fluor-liddicoatite
 
Aurisicchio C, Demartin F, Ottolini L, Pezzotta F
 
European Journal of Mineralogy 11 (1999) 237-242
Homogeneous liddicoatite from Madagascar: a possible
reference material? First EMPA, SIMS and SREF data
Sample: 2
Locality: Madagascar
_database_code_amcsd 0006767
15.882 15.882 7.115 90 90 120 R3m
atom      x      y      z  occ Biso
CaX       0      0  .2361 .452  .66
NaX       0      0  .2361 .435  .66
KX        0      0  .2361  .04  .66
LiY  .93825 .06175  .6308  2/3 .651
AlY  .93825 .06175  .6308  1/3 .651
AlZ  .29725 .26030 .61261      .460
Si   .19207 .19018 .00057      .360
B    .10938 .89062  .4548       .54
F1    .9888  .0112  .7874 .109 1.33
O1    .9888  .0112  .7874 .094 1.33
OH1   .9888  .0112  .7874 .130 1.33
OH1   .2696  .1348  .5099       .86
O2   .06047 .93953  .4800      1.60
O3   .09251 .18502  .0736       .74
O4    .1849 .09245  .0953       .75
O5   .19646 .18665  .7768       .63
O6   .28575 .28560  .0820       .56
O7   .20969 .27035  .4429       .66
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Fluor-liddicoatite
 
Rozhdestvenskaya I V, Bronzova Y M, Frank-Kamenetskaya O V
Zolotarev A A, Kuznetsova L G, Bannova I I
 
Crystallography Reports 53 (2008) 223-227
Refinement of the crystal structure of calcium-lithium-aluminum tourmaline
from the pegmatite vein in the Sangilen Upland (Tuva Republic)
Locality: Sangilen Upland, Tuva Republic
_database_code_amcsd 0012397
15.894 15.894 7.115 90 90 120 R3m
atom      x      y     z occ  Uiso
CaX       0      0 .2289 .62 .0130
NaX       0      0 .2289 .32 .0130
AlY  .12379 .06190 .6319 .36 .0044
LiY  .12379 .06190 .6319 .33 .0044
FeY  .12379 .06190 .6319 .22 .0044
MgY  .12379 .06190 .6319 .08 .0044
TiY  .12379 .06190 .6319 .01 .0044
AlZ  .29735 .26050 .6113     .0052
SiT  .19223 .19026     0     .0044
B     .1094  .2188 .4533     .0058
FO1       0      0 .7861 .84 .0330
OH11  .0329  .0165  .797 .05 .0100
O2    .0600  .1200 .4784     .0151
O3    .2702  .1351 .5097     .0084
O4    .0921  .1842 .0727     .0087
O5    .1840  .0920 .0947     .0087
O6    .1968  .1868 .7754     .0067
O7    .2859  .2857 .0813     .0060
O8    .2097  .2702 .4408     .0069
H      .252   .126  .415 .76 .0400
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