|
Ottoite |
| |
Kampf A R, Housley R M, Mills S J, Marty J, Thorne B |
| |
American Mineralogist 95 (2010) 1329-1336 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: |
|
I. Ottoite, Pb2TeO5, a new mineral with chains of tellurate octahedra |
|
Locality: Otto Mountain, Baker, California, USA |
|
_database_code_amcsd 0017558 |
|
7.5353 5.7142 10.8981 90 91.330 90 I2/a |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .34125 .00490 .33909 .0125 .0089 .0134 .0152 .0010 -.0003 .0012 |
|
Te .5 .5 .5 .0063 .0052 .0069 .0069 -.0002 .0008 .0007 |
|
O1 .5726 .7973 .4417 .013 .010 .008 .021 -.002 -.002 .010 |
|
O2 .4653 .3854 .3373 .014 .016 .020 .006 -.007 .000 -.003 |
|
O3 .25 .6256 .5 .010 .002 .010 .017 .000 .002 .000 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Housleyite |
| |
Kampf A R, Marty J, Thorne B |
| |
American Mineralogist 95 (2010) 1337-1342 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: |
|
II. Housleyite, Pb6CuTe4O18(OH)2, a new mineral with Cu-Te octahedral sheets |
|
Locality: Otto Mountain, Baker, California, USA |
|
_database_code_amcsd 0017559 |
|
7.8552 10.4836 11.0426 90 95.547 90 P2_1/n |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb1 .34533 .18063 .57768 .0127 .0139 .0141 .0098 .0011 -.0005 .0007 |
|
Pb2 .45212 .53120 .66438 .0195 .0243 .0236 .0117 -.0124 .0075 -.0038 |
|
Pb3 .97051 .62715 .60367 .0184 .0143 .0239 .0166 -.0046 -.0009 .0046 |
|
Cu .5 .5 1 .0099 .0108 .0094 .0092 -.0012 -.0009 -.0006 |
|
Te1 .15518 .36603 .80124 .0064 .0069 .0071 .0050 -.0001 -.0003 -.0001 |
|
Te2 .79491 .24012 .60876 .0067 .0071 .0075 .0055 -.0002 -.0001 .0002 |
|
O1 .9867 .1837 .5294 .011 .011 .014 .011 .000 .006 .003 |
|
O2 .3556 .4708 .8464 .009 .006 .012 .009 -.006 -.002 .002 |
|
O3 .6314 .1811 .4692 .008 .008 .014 .002 -.004 .001 .001 |
|
O4 .9378 .2708 .7623 .009 .006 .011 .008 -.003 -.003 .001 |
|
O5 .2719 .2069 .7829 .009 .012 .008 .006 .005 -.002 .002 |
|
O6 .1875 .4107 .6398 .015 .020 .019 .005 -.009 .000 .000 |
|
O7 .4811 .0130 .6798 .012 .012 .010 .016 -.001 .004 -.001 |
|
O8 .8162 .4033 .5396 .016 .020 .011 .016 -.001 -.002 .002 |
|
O9 .5924 .2811 .6814 .014 .013 .021 .009 -.003 .002 -.002 |
|
Oh .7945 .0613 .6673 .015 .009 .020 .015 .000 .000 .004 |
|
H .695 .081 .697 .050 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Thorneite |
| |
Kampf A R, Housley R M, Marty J |
| |
American Mineralogist 95 (2010) 1548-1553 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: III. |
|
Thorneite, Pb6(Te6+2O10)(CO3)Cl2(H2O), the first mineral with |
|
edge-sharing octahedral tellurate dimers |
|
Locality: Otto Mountain, Baker, California |
|
_database_code_amcsd 0017719 |
|
21.305 11.059 7.564 90 101.112 90 C2/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb1 .63753 .09635 .15303 .0186 .0139 .0241 .0165 .0015 -.0005 -.0012 |
|
Pb2 .69515 .41296 .96922 .0220 .0218 .0233 .0195 -.0020 .0007 -.0021 |
|
Pb3 .55264 .24366 .52254 .0283 .0177 .0376 .0279 .0056 .0006 -.0047 |
|
Te .78842 .30010 .36271 .0134 .0114 .0160 .0128 -.0030 .0024 -.0008 |
|
C .5 .9822 .25 .025 .028 .017 .025 .0 -.010 .0 |
|
Cl .5884 .3933 .1682 .75 .057 .032 .080 .059 .006 .009 -.002 |
|
OH .5884 .3933 .1682 .25 .057 .032 .080 .059 .006 .009 -.002 |
|
O1 .5 .0990 .25 .052 .034 .033 .079 .0 -.015 .0 |
|
O2 .5487 .9265 .2183 .044 .022 .049 .063 .001 .013 -.009 |
|
O3 .7815 .4526 .2479 .026 .024 .028 .021 -.011 -.006 .008 |
|
O4 .6451 .2717 .7367 .020 .016 .028 .016 -.008 .003 -.012 |
|
O5 .7269 .2338 .1654 .016 .013 .019 .014 -.004 -.004 .004 |
|
O6 .6435 .1381 .4534 .014 .008 .025 .010 -.001 .003 -.002 |
|
O7 .7201 .3460 .4937 .012 .011 .013 .014 .002 .008 -.003 |
|
Owat .5 .391 .75 .089 .095 .094 .081 .0 .022 .0 |
|
H .525 .442 .829 .08 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Markcooperite |
| |
Kampf A R, Mills S J, Housley R M, Marty J, Thorne B |
| |
American Mineralogist 95 (2010) 1554-1559 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: IV. |
|
Markcooperite, Pb(UO2)Te6+O6, the first natural uranyl tellurate |
|
Locality: Otto Mountain, Baker, California |
|
_database_code_amcsd 0017720 |
|
5.722 7.7478 7.889 90 90.833 90 P2_1/c |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .4972 .1689 .6919 .0531 .044 .051 .064 -.003 -.003 .002 |
|
U1 0 0 0 .75 .0386 .035 .039 .042 .003 .003 .002 |
|
Te1 0 0 0 .25 .0386 .035 .039 .042 .003 .003 .002 |
|
Te2 0 .5 0 .0339 .029 .034 .039 -.003 -.001 .002 |
|
O1 .699 -.068 -.061 .054 .05 .05 .07 .01 -.03 .01 |
|
O2 -.137 .234 .505 .038 .06 .02 .03 .00 -.02 .00 |
|
O3 .295 .085 .429 .045 .02 .05 .06 .00 .00 .03 |
|
O4 -.114 .532 -.237 .040 .03 .02 .07 -.00 -.01 .01 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Timroseite |
| |
Kampf A R, Mills S J, Housley R M, Marty J, Thorne B |
| |
American Mineralogist 95 (2010) 1560-1568 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: V. |
|
Timroseite, Pb2Cu2+5(Te6+O6)2(OH)2, and paratimroseite, |
|
Pb2Cu2+4(Te6+O6)2(H2O)2, two new tellurates with Te-Cu polyhedral sheets |
|
Locality: Otto Mountain, Baker, California |
|
_database_code_amcsd 0017721 |
|
5.2000 9.6225 11.5340 90 90 90 P2_1nm |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb1 .1230 .0356 0 .94 .0229 .0198 .0213 .0277 .0041 0 0 |
|
Pb1a .125 .077 0 .09 .060 .11 .037 .035 .032 0 0 |
|
Pb2 .3820 .38682 .5 .84 .0208 .0170 .0178 .0277 .0013 0 0 |
|
Pb2a .279 .396 .5 .17 .062 .07 .075 .045 -.018 0 0 |
|
Cu1 .6694 .89920 .18488 .0146 .0131 .0093 .0214 .0003 .0017 -.0021 |
|
Cu2 .7204 .59878 .32206 .0155 .0136 .0108 .0220 -.0026 .0036 -.0022 |
|
Cu3 .1304 .7144 .5 .0222 .0194 .0267 .0204 .0026 0 0 |
|
Te .2005 .74917 .24990 .0122 .0109 .0092 .0165 -.0004 .0001 .0003 |
|
O1 .3817 .6747 .3817 .0160 .006 .021 .021 .009 .004 .001 |
|
O2 .0013 .8259 .1236 .0143 .015 .014 .014 -.005 -.005 .006 |
|
O3 .3533 .9309 .2788 .0189 .021 .010 .025 -.004 -.005 -.002 |
|
O4 .9192 .7716 .3612 .0135 .010 .014 .016 -.006 -.003 .002 |
|
O5 .0365 .5718 .2178 .0160 .011 .006 .031 .005 .008 -.001 |
|
O6 .5044 .7173 .1587 .018 .022 .005 .026 -.005 .007 -.009 |
|
OH1 .530 .9473 0 .021 .017 .023 .023 .002 0 0 |
|
OH2 .798 .5066 .5 .024 .010 .040 .022 .003 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Paratimroseite |
| |
Kampf A R, Mills S J, Housley R M, Marty J, Thorne B |
| |
American Mineralogist 95 (2010) 1560-1568 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: V. |
|
Timroseite, Pb2Cu2+5(Te6+O6)2(OH)2, and paratimroseite, |
|
Pb2Cu2+4(Te6+O6)2(H2O)2, two new tellurates with Te-Cu polyhedral sheets |
|
Locality: Otto Mountain, Baker, California |
|
_database_code_amcsd 0017722 |
|
5.1943 9.6198 11.6746 90 90 90 P2_12_12_1 |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb .48658 .37646 .71849 .0199 .0182 .0224 .0192 .0012 .0004 .0041 |
|
Cu1 .3802 .6442 .5457 .0148 .0090 .0157 .0196 .0007 -.0011 .0012 |
|
Cu2 .4205 .3513 .4222 .0145 .0090 .0159 .0184 -.0012 -.0015 .0005 |
|
Te .8986 .49499 .49034 .0124 .0100 .0117 .0155 .0000 -.0003 -.0003 |
|
O1 .608 .5291 .3914 .016 .018 .015 .016 -.007 -.012 .002 |
|
O2 .195 .4730 .5870 .012 |
|
O3 .544 .8222 .5322 .023 |
|
O4 .741 .3179 .5188 .022 .018 .007 .041 -.010 .003 .005 |
|
O5 .415 .5715 .8624 .017 .007 .032 .012 .000 .000 -.003 |
|
O6 .696 .5660 .6193 .019 .018 .028 .011 .001 .010 -.002 |
|
Wat .473 .7477 .2604 .024 .043 .008 .020 -.003 .008 -.005 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Telluroperite |
| |
Kampf A R, Mills S J, Housley R M, Marty J, Thorne B |
| |
American Mineralogist 95 (2010) 1569-1573 |
|
Lead-tellurium oxysalts from Otto Mountain near Baker, California: |
|
VI. Telluroperite, Pb3Te4+O4Cl2, the Te analog of perite and nadorite |
|
Locality: Otto Mountain, Baker, California |
|
_database_code_amcsd 0017747 |
|
5.5649 5.5565 12.4750 90 90 90 Bmmb |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Pb1 0 .25 .3892 .021 .016 .018 .028 0 0 0 |
|
Pb2 0 .25 .0961 .50 .025 .013 .010 .052 0 0 0 |
|
Te2 0 .25 .0961 .50 .025 .013 .010 .052 0 0 0 |
|
O .763 0 0 .018 .016 .021 .018 0 0 -.001 |
|
Cl 0 .25 .7473 .013 .019 .018 .000 0 0 0 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Dickthomssenite |
 |
Hughes J M, Cureton F E, Marty J, Gault R A, Gunter M E, |
|
Campana C F, Rakovan J F, Sommer A J, Brueseke M E |
 |
The Canadian Mineralogist 39 (2001) 1691-1700 |
|
Dickthomssenite, Mg(V2O6).7H2O, a new mineral species from the Firefly-Pigmay mine, Utah: |
|
Descriptive mineralogy and arrangement of atoms |
|
Locality: Firefly-Pigmay mine, Utah, USA |
|
_database_code_amcsd 0005758 |
|
38.954 7.2010 16.3465 90 97.602 90 C2/c |
|
atom x y z Uiso |
|
V1 .1506 .1163 .2101 .008 |
|
V2 .0991 .3673 .2912 .009 |
|
V3 .1518 .6170 .2117 .009 |
|
V4 .0987 .8661 .2904 .009 |
|
Mg1 .1255 .6238 .0018 .019 |
|
Mg2 0 1/2 0 .021 |
|
Mg3 3/4 3/4 1/2 .022 |
|
O1 .1132 .1176 .2833 .020 |
|
O2 .1364 .3688 .2184 .019 |
|
O3 .1157 .6180 .2906 .016 |
|
O4 .1346 .8663 .2117 .016 |
|
O5 .1895 .1120 .2605 .023 |
|
O6 .1547 .1253 .1095 .018 |
|
O7 .0607 .3744 .2388 .022 |
|
O8 .0930 .6350 -.1086 .015 |
|
O9 .1896 .6249 .2653 .023 |
|
O10 .1581 .6154 .1119 .015 |
|
O11 .0604 .8582 .2377 .024 |
|
O12 .0937 .8754 .3903 .022 |
|
Ow13 .1435 .8942 -.0206 .026 |
|
H13A .1250 .9576 -.0237 .031 |
|
H13B .1553 .9412 .0218 .031 |
|
Ow14 .0900 .7474 .0675 .036 |
|
H14A .0964 .7313 .1188 .044 |
|
H14B .0847 .8543 .0477 .044 |
|
Ow15 .1062 .3563 .0191 .025 |
|
H15A .1113 .2898 -.0205 .029 |
|
H15B .0954 .2869 .0492 .029 |
|
Ow16 .1607 .4948 -.0646 .038 |
|
H16A .1621 .5505 -.1098 .045 |
|
H16B .1807 .4920 -.0367 .045 |
|
Ow17 -.0264 .5035 .0997 .025 |
|
H17A -.0332 .6136 .1072 .030 |
|
H17B -.0131 .4663 .1420 .030 |
|
Ow18 .0416 .3922 .0715 .040 |
|
H18A .0352 .2958 .0953 .048 |
|
H18B .0572 .3634 .0421 .048 |
|
Ow19 -.0188 .2306 -.0267 .030 |
|
H19A -.0056 .1600 .0052 .036 |
|
H19B -.0332 .1581 -.0542 .036 |
|
Ow20 .7762 .7523 .4015 .028 |
|
H20A .7723 .6677 .3652 .034 |
|
H20B .7803 .8633 .3878 .034 |
|
Ow21 .7918 .8566 .5734 .039 |
|
H21A .7966 .9656 .5586 .046 |
|
H21B .8097 .7911 .5697 .046 |
|
Ow22 .7680 .4802 .5271 .030 |
|
H22A .7561 .4064 .4941 .036 |
|
H22B .7829 .4102 .5546 .036 |
|
Ow23 .7503 .4161 .2475 .024 |
|
H23A .7684 .4801 .2440 .029 |
|
H23B .7425 .3657 .2018 .029 |
|
Ow24 .7748 .2516 .3974 .030 |
|
H24A .7614 .1811 .4204 .036 |
|
H24B .7956 .2169 .3965 .036 |
|
Ow25 .9755 .0019 .6015 .028 |
|
H25A .9547 .0393 .6005 .034 |
|
H25B .9887 .0726 .5782 .034 |
|
Ow26 0 .3382 3/4 .026 |
|
H26 .9814 .3070 .7682 .031 |
|
Ow27 0 .8307 3/4 .030 |
|
H27 .9926 .8833 .7045 .036 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Rakovanite |
| |
Kampf A R, Hughes J M, Marty J, Gunter M E, Nash B |
| |
The Canadian Mineralogist 49 (2011) 595-604 |
|
Rakovanite, Na3{H3[V10O28]}*15H2O, a new member of the |
|
pascoite family with a protonated decavanadate polyanion |
|
Locality: Synthetic |
|
_database_code_amcsd 0018383 |
|
12.0248 17.121 18.140 90 106.242 90 P2_1/n |
|
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
V1 .06629 -.12903 .10294 .0195 .0198 .0252 .0118 -.0010 .0014 -.0001 |
|
V2 -.01357 -.12711 .24943 .0194 .0165 .0234 .0175 -.0011 .0035 .0005 |
|
V3 .13092 -.21570 .39482 .0212 .0249 .0206 .0184 -.0028 .0065 .0031 |
|
V4 .12453 -.03548 .39361 .0206 .0236 .0211 .0175 .0011 .0063 -.0009 |
|
V5 .28535 -.03402 .10014 .0222 .0263 .0237 .0169 -.0002 .0065 .0047 |
|
V6 .29434 -.21384 .10274 .0226 .0282 .0214 .0189 .0011 .0079 -.0026 |
|
V7 .43406 -.12108 .24686 .0182 .0187 .0206 .0151 .0005 .0047 .0001 |
|
V8 .35254 -.12222 .39303 .0181 .0187 .0199 .0144 -.0001 .0029 .0004 |
|
V9 .21232 -.22040 .24850 .0175 .0205 .0154 .0154 -.0004 .0029 -.0010 |
|
V10 .20634 -.02923 .24729 .0170 .0196 .0133 .0176 .0001 .0043 .0001 |
|
Na1 .28198 .12442 -.06503 .0394 .0355 .0560 .0272 .0021 .0095 .0038 |
|
Na2 -.19310 .13984 .16880 .0316 .0322 .0291 .0343 .0057 .0107 -.0028 |
|
Na3 -.30959 .10623 .32547 .0325 .0325 .0328 .0318 .0038 .0083 -.0036 |
|
O1 -.0685 -.1316 .05411 .0246 .020 .033 .018 -.001 -.0005 .001 |
|
O2 -.1445 -.1279 .19691 .0238 .0161 .027 .024 .0005 -.0009 -.001 |
|
O3 .1063 -.2848 .4479 .0295 .034 .026 .027 -.003 .007 .006 |
|
O4 .0949 .0321 .4462 .0271 .028 .027 .028 .0034 .011 -.012 |
|
O5 .3102 .0344 .0477 .0315 .038 .034 .024 -.003 .012 .009 |
|
O6 .3261 -.2819 .0520 .0341 .042 .034 .029 .007 .015 -.007 |
|
O7 .5663 -.1197 .29885 .0238 .016 .031 .023 -.001 .0021 -.000 |
|
O8 .4860 -.1193 .44337 .0236 .0201 .0293 .0182 -.0022 .0004 -.0033 |
|
O9 .2438 -.1249 .18500 .0160 .0197 .0160 .0110 .0027 .0023 .003 |
|
O10 .1733 -.1244 .31152 .0166 .017 .017 .016 .0034 .0039 -.0017 |
|
O11 .0566 -.1995 .1887 .0183 .020 .018 .017 -.0040 .0039 -.0011 |
|
O12 .0531 -.0549 .1874 .0174 .015 .025 .011 -.0018 .0007 .0029 |
|
O13 -.0107 -.2059 .3193 .022 .027 .021 .017 .004 .004 .001 |
|
O14 -.0162 -.0489 .3178 .0213 .017 .023 .024 .001 .0063 -.005 |
|
O15 .1005 -.1256 .44121 .0215 .023 .025 .017 -.001 .006 -.003 |
|
O16 .2911 -.2009 .4359 .0192 .025 .018 .013 -.0005 .0022 .0035 |
|
O17 .1775 -.2786 .3143 .0209 .020 .020 .021 -.003 .004 .000 |
|
O18 .2864 -.0440 .4350 .020 .018 .025 .019 -.003 .007 .000 |
|
O19 .1678 .0296 .3111 .0199 .022 .014 .023 -.0008 .004 -.001 |
|
O20 .3662 -.1947 .3095 .0177 .021 .015 .015 .0005 .0027 -.0042 |
|
O21 .3611 -.0505 .3077 .0160 .019 .015 .014 -.0013 .0031 -.0044 |
|
O22 .4274 -.0438 .1780 .0199 .017 .025 .018 .0013 .0052 .0008 |
|
O23 .4333 -.2005 .1802 .0217 .024 .019 .023 .003 .0076 -.000 |
|
O24 .3174 -.1239 .05489 .0238 .027 .029 .017 .001 .008 -.001 |
|
O25 .2403 .0302 .1819 .0178 .018 .018 .018 -.0018 .0055 .001 |
|
O26 .1321 -.2054 .0609 .0238 .027 .028 .014 -.0022 .0039 -.0042 |
|
O27 .1274 -.0487 .0606 .0212 .024 .024 .015 -.0029 .0028 .0020 |
|
O28 .2501 -.2792 .1851 .0216 .026 .018 .019 -.000 .0027 -.003 |
|
O29 .3867 .0315 -.1112 .044 .040 .042 .058 .002 .026 .012 |
|
O30 .3741 .2151 -.1225 .038 .036 .043 .039 .002 .016 -.004 |
|
O31 -.1394 .2460 .0980 .040 .046 .039 .031 -.014 .004 -.003 |
|
O32 -.1075 .0522 .1008 .0414 .058 .042 .022 .026 .008 .004 |
|
O33 -.3840 .1286 .0765 .0434 .041 .062 .030 .005 .014 .001 |
|
O34 -.0071 .1488 .2551 .0491 .037 .028 .065 .002 -.014 -.008 |
|
O35 -.2763 .2187 .2423 .044 .031 .049 .044 .018 -.003 -.018 |
|
O36 -.2299 .0291 .2481 .038 .037 .042 .031 .007 .003 -.006 |
|
O37 -.1203 .1231 .4046 .039 .033 .054 .029 .011 .007 -.003 |
|
O38 -.5030 .1020 .2521 .047 .049 .026 .054 .010 -.005 -.012 |
|
O39 -.3414 .0025 .4106 .0476 .063 .046 .031 -.027 .009 -.002 |
|
O40 -.3779 .1955 .4015 .043 .059 .043 .021 .024 .002 -.002 |
|
O41 .1760 .1302 .5923 .071 .061 .084 .079 .006 .035 .002 |
|
O42 .0907 .1558 .1100 .0471 .053 .040 .043 .012 .006 .017 |
|
O43 .0942 -.3993 .1080 .0518 .055 .040 .055 .000 .007 -.002 |
|
H29A .382 -.0128 -.097 .03 |
|
H29B .445 .046 -.123 .08 |
|
H30A .427 .203 -.140 .06 |
|
H30B .393 .2615 -.118 .04 |
|
H31A -.078 .266 .118 .04 |
|
H31B -.128 .253 .057 .03 |
|
H32A -.115 .040 .0563 .008 |
|
H32B -.075 .025 .121 .02 |
|
H33A -.358 .141 .041 .08 |
|
H33B -.433 .163 .066 .17 |
|
H34A .047 .120 .273 .03 |
|
H34B .020 .191 .265 .05 |
|
H35A -.337 .242 .224 .02 |
|
H35B -.243 .244 .280 .018 |
|
H36A -.278 .002 .218 .06 |
|
H36B -.168 .009 .270 .11 |
|
H37A -.062 .105 .396 .04 |
|
H37B -.101 .123 .452 .08 |
|
H38A -.510 .065 .226 -.009 |
|
H38B -.560 .129 .236 .07 |
|
H39A -.387 -.033 .409 .024 |
|
H39B -.327 .019 .454 .10 |
|
H40A -.355 .186 .447 .08 |
|
H40B -.413 .235 .382 .09 |
|
H41A .213 .088 .596 .12 |
|
H41B .118 .126 .608 .12 |
|
H42A .136 .120 .131 .008 |
|
H42B .088 .167 .0647 .11 |
|
H43A .064 -.440 .087 .33 |
|
H43B .149 -.371 .129 .19 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
|
Gunterite |
| |
Kampf A R, Hughes J M, Marty J, Nash B |
| |
The Canadian Mineralogist 49 (2011) 1243-1251 |
|
Gunterite, Na4(H2O)16(H2V10O28)*6H2O, a new mineral species |
|
with a doubly-protonated decavanadate polyanion: |
|
crystal structure and descriptive mineralogy |
|
Locality: West Sunday mine, San Miguel County, Colorado, USA |
|
_database_code_amcsd 0018627 |
|
19.848 10.1889 13.1184 90 130.187 90 C2/m |
|
atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
|
Na1 .3134 .5 .0401 .066 .059 .047 .098 0 .053 0 |
|
Na2 .623 .5 .344 .56 .056 .045 .044 .09 0 .046 0 |
|
Ca2 .6693 .5 .413 .44 .052 .045 .044 .083 0 .048 0 |
|
V1 0 .3386 .5 .0337 .0303 .0280 .049 0 .0284 0 |
|
V2 .93435 .5 .6285 .0368 .0310 .0355 .051 0 .0297 0 |
|
V3 .82092 .5 .3223 .0367 .0289 .0355 .051 0 .0280 0 |
|
V4 .88655 .34890 .1951 .0392 .0361 .0339 .0504 -.0010 .0291 -.0023 |
|
O1 .7338 .5 .3092 .045 .033 .047 .055 0 .029 0 |
|
O2 .8454 .5 .6088 .046 .042 .049 .061 0 .040 0 |
|
O3 .9494 .2369 .3644 .037 .035 .033 .050 -.003 .030 -.003 |
|
O4 .8477 .5 .0940 .039 .041 .027 .049 0 .029 0 |
|
O5 .0504 .5 .6337 .033 .031 .029 .049 0 .030 0 |
|
O6 .8977 .6222 .4811 .033 .029 .027 .050 .001 .028 -.001 |
|
O7 .9995 .6317 .7489 .041 .038 .033 .057 -.001 .033 -.004 |
|
O8 .8491 .2304 .0891 .048 .048 .036 .061 -.004 .035 -.009 |
|
O9 .7991 .3685 .2102 .037 .033 .036 .049 -.002 .029 -.004 |
|
OW1 .4161 .5 .0050 .073 .062 .065 .092 0 .050 0 |
|
OW2 .3211 .5 .2369 .099 .107 .102 .100 0 .072 0 |
|
OW3 .5651 .6650 .2031 .108 .133 .049 .215 -.006 .146 -.025 |
|
OW4 .7011 .6773 .5326 .084 .082 .070 .126 .025 .079 .014 |
|
OW5 .5270 .5 .376 .223 .32 .056 .56 0 .41 0 |
|
OW6 .6693 .1947 .1683 .089 .091 .085 .109 .009 .074 .015 |
|
OW7 .583 0 .026 .183 .37 .093 .140 0 .19 0 |
|
OW8 .7600 .5 .684 .134 .166 .104 .19 0 .140 0 |
|
H1A .3985 .4392 .0275 2 |
|
H2A .3833 .5 .2530 .119 |
|
H2B .3724 .5 .3286 .119 |
|
H3A .6107 .6836 .2763 .129 |
|
H3B .5409 .7302 .2024 .129 |
|
H4A .7065 .6472 .6003 .04 |
|
H4B .6634 .7269 .5318 .13 |
|
H5 .5069 .4289 .3773 .4 |
|
H6A .6433 .2706 .1287 .13 |
|
H6B .7230 .2130 .1952 .27 |
|
H7A .5582 0 -.0597 .01 |
|
H7B .5259 0 -.0078 .07 |
|
H8A .80 .5 .67 2 |
|
H8B .71 .5 .60 2 |
|
|
| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure
|
| |
Multiple datasets can be concatenated into a single downloadable file by
selecting the datasets and then hitting the "Download Selected Data" button.
