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Mrazekite |
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Ridkosil T, Srein V, Fabry J, Hybler J, Maximov B A |
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The Canadian Mineralogist 30 (1992) 215-224 |
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Mrazekite, Bi2Cu3(OH)2O2(PO4)2.2H2O, a new mineral species |
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and its crystal structure |
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_database_code_amcsd 0005275 |
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12.359 6.331 9.060 90 122.71 90 C2/m |
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atom x y z Biso |
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Bi .1595 0 .0907 1.54 |
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Cu1 0 .5 0 1.2 |
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Cu2 .25 .25 .5 1.75 |
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P .3061 .5 .2522 1.1 |
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O1 .1639 0 .3607 1.9 |
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OH2 .0856 0 -.2146 2.0 |
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O3 .1805 .5 .0691 2.2 |
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O4 0 .2070 0 2.2 |
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O5 .3153 .3028 .3526 3.3 |
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Wat6 .0366 .5 .3248 3.1 |
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Mrazekite |
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Effenberger H, Krause W, Belendorff K, Bernhardt H J, Medenbach O, Hybler J, Petricek V |
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The Canadian Mineralogist 32 (1994) 365-372 |
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Revision of the crystal structure of mrazekite, Bi2Cu3(OH)2O2(PO4)2.2H2O |
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_database_code_amcsd 0005364 |
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9.065 6.340 21.239 90 101.57 90 P2_1/n |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Bi1 .36464 .25135 .04570 .0185 .0160 .0155 .0003 .0034 .0002 |
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Bi2 .38662 .19971 .20523 .0173 .0161 .0147 .0000 .0031 .0000 |
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Cu1 0 0 0 .0171 .0173 .0248 -.0016 .0037 -.0001 |
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Cu2 0 .5 0 .0174 .0167 .0248 .0023 .0039 .0007 |
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Cu3 .3719 .7251 .1251 .0276 .0134 .0151 .0000 .0035 .0002 |
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Cu4 .7461 .4532 .2469 .0171 .0188 .0247 -.0024 .0041 .0001 |
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P1 .7237 .2688 .0281 .0178 .0164 .0166 .0007 .0042 .0004 |
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P2 .0284 .2192 .2226 .0181 .0160 .0147 -.0001 .0042 .0001 |
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O11 .631 .247 .0803 .020 .036 .028 .002 .007 .0000 |
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O12 .809 .064 .0224 .026 .015 .037 -.002 .006 .0000 |
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O13 .610 .315 -.0345 .030 .033 .014 -.006 .004 -.003 |
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O14 .832 .460 .0417 .022 .022 .031 .000 .005 .000 |
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O21 .115 .189 .1690 .012 .027 .017 -.002 .001 .000 |
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O22 -.056 .013 .2299 .020 .020 .033 .000 .006 -.002 |
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O23 -.081 .407 .2086 .022 .022 .039 .000 .009 .002 |
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O24 .147 .267 .2847 .023 .032 .019 .001 .005 -.001 |
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Oo1 .378 .025 .1200 .023 .018 .019 .004 .004 .003 |
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Oo2 .372 .425 .1307 .022 .014 .020 .002 .005 .000 |
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OH1 .652 .195 .2068 .024 .020 .019 -.001 .005 .000 |
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OH2 .099 .254 .0436 .018 .018 .026 .002 .003 .002 |
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Wat1 .065 .769 .1050 .034 .052 .026 -.008 .004 -.001 |
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Wat2 .685 .735 .1403 .064 .065 .021 -.012 -.002 .000 |
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Vistepite |
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Hybler J, Petricek V, Jurek K, Skala R, Cisarova I |
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The Canadian Mineralogist 35 (1997) 1283-1292 |
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Structure determination of vistepite SnMn4B2Si4O16(OH)2: Isotypism with |
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bustamite, revised crystallographic data and composition |
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_database_code_amcsd 0005531 |
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6.973 7.365 7.665 89.94 62.94 76.88 P-1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Sn 0 0 0 .0067 .0090 .0044 -.0021 -.0009 .0016 |
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Mn1 .8108 .2762 -.2634 .0129 .0165 .0076 -.0041 -.0028 .0028 |
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Mn2 .3042 .2866 -.2623 .0083 .0156 .0095 -.0011 -.0007 .0026 |
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Si1 .0742 .3274 .2426 .0060 .013 .007 -.0036 -.002 .0030 |
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Si2 .5327 .3252 .2216 .006 .015 .006 -.003 -.001 .0022 |
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B -.252 .122 .431 .012 .013 .007 -.007 -.005 .005 |
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H .32 .02 .33 .10 |
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O1 -.141 -.0431 .2885 .015 .013 .012 -.007 -.005 .003 |
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O2 .1201 .2174 .0375 .017 .017 .009 -.009 -.005 .002 |
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O3 .5650 .2549 .4109 .012 .017 .012 -.001 -.006 -.001 |
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O4 .7282 .1939 .0237 .013 .014 .012 -.004 -.006 .005 |
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O5 -.0897 .2296 .4247 .010 .015 .011 -.009 -.004 .003 |
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O6 .3012 .2750 .2618 .013 .020 .015 -.009 -.004 .007 |
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O7 -.016 .5495 .2636 .014 .013 .017 -.002 -.008 .001 |
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O8 .513 .5445 .2045 .013 .016 .014 -.004 -.006 .001 |
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O9 -.357 .0827 .6397 .012 .016 .007 -.006 -.001 .005 |
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Zinnwaldite-2M1 |
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Rieder M, Hybler J, Smrcok L, Weiss Z |
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European Journal of Mineralogy 8 (1996) 1241-1248 |
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Refinement of the crystal structure of zinnwaldite 2M_1 |
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Locality: Barbora mine, Krupka, Czech Republic |
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_database_code_amcsd 0006631 |
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5.292 9.187 19.935 90 95.40 90 Cc |
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atom x y z occ Uiso |
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KMi 0 .0894 .25 .978 .0271 |
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FeM1 .2611 .7539 .0000 .59 .0116 |
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LiM1 .2611 .7539 .0000 .27 .0116 |
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AlM2 .7657 .5882 .0001 .9 .0108 |
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FeM2 .7657 .5882 .0001 .1 .0108 |
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FeM3 -.7421 -.5808 -.0005 .644 .0117 |
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LiM3 -.7421 -.5808 -.0005 .216 .0117 |
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SiT1 .4629 .9256 .1365 .81 .0095 |
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AlT1 .4629 .9256 .1365 .19 .0095 |
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SiT11 -.4628 -.9178 -.1363 .75 .0100 |
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AlT11 -.4628 -.9178 -.1363 .25 .0100 |
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SiT2 .9621 .7531 .1371 .79 .0134 |
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AlT2 .9621 .7531 .1371 .21 .0134 |
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SiT21 -.9557 -.7549 -.1357 .76 .0063 |
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AlT21 -.9557 -.7549 -.1357 .24 .0063 |
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O1 .4337 .9390 .0545 .0143 |
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O11 -.4479 -.9123- .0526 .0088 |
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O2 .9344 .7417 .0541 .0099 |
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O21 -.9079 -.7635 -.0524 .0116 |
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O3 .9466 .5898 .1699 .0197 |
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O31 -.9371 -.5872 -.1637 .0211 |
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O4 .2403 .8240 .1637 .0212 |
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O41 -.2321 -.8226 -.1640 .0194 |
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O5 .7384 .8543 .1644 .0193 |
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O51 -.7337 -.8504 -.1692 .0170 |
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OH .4873 .5874 .0507 .545 .0214 |
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F .4873 .5874 .0507 .455 .0214 |
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OH1 -.4020 -.5599 -.0497 .545 .0216 |
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F1 -.4020 -.5599 -.0497 .455 .0216 |
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|
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Lindackerite |
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Hybler J, Ondrus P, CiSarova I, Petricek V, Veselovsky F |
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European Journal of Mineralogy 15 (2003) 1035-1042 |
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Crystal structure of lindackerite, (Cu,Co,Ni)Cu4(AsO4)2(AsO3OH)2*9H2O |
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from Jachymov, Czech Republic |
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Sample: #MZKJ |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0007023 |
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6.440 8.065 10.411 85.44 79.38 84.65 P-1 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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As1 -.0764 .3829 .3645 .0131 .0135 .0092 .0165 -.0048 -.003 .0030 |
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As2 .4236 -.0110 .3321 .0105 .0116 .0085 .0113 -.0058 -.0012 .0028 |
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Cu1 .3924 .3654 .4424 .0168 .0128 .0123 .0264 -.0048 -.0039 -.0033 |
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Cu2 .9004 -.0752 .4004 .0140 .0136 .0132 .0158 -.0070 -.0025 .0031 |
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CoM .5 0 0 .27 .0162 .020 .017 .0110 -.0099 -.0004 .0053 |
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NiM .5 0 0 .15 .0162 .020 .017 .0110 -.0099 -.0004 .0053 |
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CuM .5 0 0 .52 .0162 .020 .017 .0110 -.0099 -.0004 .0053 |
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O11 .015 .5197 .2431 .030 .046 .018 .022 -.015 .010 .004 |
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O12 -.320 .4388 .4482 .016 .013 .011 .023 -.002 -.004 .001 |
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O13 .092 .3313 .4669 .018 .017 .012 .027 -.009 -.010 .007 |
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OH14 -.111 .2071 .2876 .019 .026 .014 .019 -.007 -.005 -.001 |
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O21 .398 -.0763 .1882 .019 .026 .022 .009 -.013 -.001 -.002 |
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O22 .187 -.0351 .4335 .013 .010 .014 .015 -.005 -.001 .003 |
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O23 .614 -.1265 .3937 .017 .011 .015 .025 -.005 -.007 .006 |
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O24 .479 .1949 .3138 .016 .022 .009 .017 -.009 .000 .006 |
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Wat1 -.066 .379 .020 .41 .05 .10 .03 .02 -.03 -.01 .010 |
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Wat2 .460 .543 .199 .078 .08 .032 .02 .006 -.032 -.004 |
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Wat31 .399 -.217 -.040 .49 .030 .04 .03 .024 -.012 -.003 -.002 |
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Wat32 .229 -.063 -.056 .54 .041 .05 .04 .03 -.010 -.005 .009 |
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Wat33 .375 .252 .039 .42 .033 .05 .03 .02 0 .008 -.008 |
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Wat34 .166 .150 .011 .57 .064 .06 .08 .04 -.01 -.01 .02 |
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Wat4 .000 -.1592 .2289 .020 .024 .019 .018 -.013 -.002 .003 |
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|
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|
| |
|
Lindackerite |
|
Hybler J, Ondrus P, CiSarova I, Petricek V, Veselovsky F |
| |
European Journal of Mineralogy 15 (2003) 1035-1042 |
|
Crystal structre of lindackerite, (Cu,Co,Ni)Cu4(AsO4)2(AsO3OH)2*9H2O |
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from Jachymov, Czech Republic |
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Sample: #J688 |
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Locality: Jachymov, Czech Republic |
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_database_code_amcsd 0007024 |
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6.415 8.048 10.332 85.41 79.50 84.71 P-1 |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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As1 -.07649 .38404 .36430 .0151 .0146 .0142 .0167 .0001 -.0018 -.0053 |
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As2 .42333 -.00981 .33156 .0125 .0123 .0143 .0109 -.0017 .0002 -.0046 |
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Cu1 .39252 .36543 .44220 .0193 .0141 .0187 .0267 .0006 -.0038 -.0132 |
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Cu2 .90005 -.07489 .40049 .0151 .0126 .0202 .0128 -.0021 .0001 -.0065 |
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CuM .5 0 0 .958 .0160 .0182 .0209 .0086 -.0048 .0009 -.0029 |
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O11 .0128 .5198 .2449 .030 .045 .020 .022 -.002 .000 -.003 |
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O12 -.3218 .4383 .4497 .020 .015 .020 .025 .000 .000 -.013 |
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O13 .0926 .3278 .4688 .0191 .017 .017 .025 -.003 -.007 -.004 |
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Oh14 -.1121 .2060 .2891 .0197 .022 .017 .021 .000 -.004 -.009 |
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O21 .3974 -.0756 .1858 .019 .022 .024 .011 -.007 .003 -.006 |
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O22 .1871 -.0356 .4331 .0149 .013 .018 .012 -.003 .002 -.006 |
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O23 .6121 -.1308 .3950 .0178 .016 .017 .021 -.001 -.003 -.002 |
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O24 .4817 .1930 .3129 .019 .022 .016 .019 -.002 -.002 -.004 |
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Wat1 -.077 .383 .0207 .52 .070 .04 .045 .027 -.042 -.018 .011 |
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Wat2 .4610 .5414 .1989 .084 .082 .047 .135 .016 -.054 -.026 |
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Wat31 .398 -.2186 -.0393 .52 .036 .045 .040 .024 -.015 .000 -.011 |
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Wat32 .225 -.0655 -.0537 .52 .031 .028 .039 .024 -.003 -.002 -.004 |
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Wat33 .3640 .265 .0356 .52 .045 .057 .047 .030 -.005 -.002 -.008 |
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Wat34 .163 .154 .0086 .53 .057 .040 .089 .039 .003 -.009 .003 |
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Wat4 .0009 -.1583 .2269 .022 .020 .028 .019 -.008 .002 -.008 |
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H41 .151 -.144 .218 .038 |
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H42 .01 -.233 .233 .038 |
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|
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Cronstedtite |
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Hybler J |
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European Journal of Mineralogy 18 (2006) 197-205 |
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Parallel intergrowths in cronstedtite-1T: |
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determination of the degree of disorder |
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Locality: Herja, Romania |
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Sample: HER |
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Note: 1T polytype |
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_database_code_amcsd 0007145 |
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5.494 5.494 7.090 90 90 120 P31m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeM1 .6653 0 .5 .0091 .0071 .0072 .0130 .0036 .0001 0 |
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SiT1 1/3 2/3 .1020 .685 .0104 .0107 .0107 .0098 .0053 0 0 |
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FeT1 1/3 2/3 .1020 .315 .0104 .0107 .0107 .0098 .0053 0 0 |
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O1 .4432 0 .0234 .0331 .042 .036 .020 .0182 -.0007 0 |
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Oh1 0 0 .3510 .013 .014 .014 .011 .0071 0 0 |
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Oh2 .3318 0 .6391 .0125 .014 .014 .009 .0071 .0001 0 |
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O4 1/3 2/3 .3458 .0137 .014 .014 .014 .0068 0 0 |
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H1 0 0 .223 .038 |
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H2 .348 0 .745 .038 |
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|
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|
| |
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Cronstedtite |
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Hybler J |
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European Journal of Mineralogy 18 (2006) 197-205 |
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Parallel intergrowths in cronstedtite-1T: |
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determination of the degree of disorder |
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Locality: Lostwithiel, England |
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Sample: LOS |
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Note: 1T polytype |
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_database_code_amcsd 0007146 |
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5.495 5.495 7.090 90 90 120 P31m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeM1 .6654 0 .5 .0096 .0073 .0074 .0141 .0037 .0000 0 |
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SiT1 1/3 2/3 .1018 .711 .0108 .0106 .0106 .0111 .0053 0 0 |
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FeT1 1/3 2/3 .1018 .289 .0108 .0106 .0106 .0111 .0053 0 0 |
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O1 .4434 0 .0247 .035 .044 .037 .022 .019 -.0007 0 |
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Oh1 0 0 .3514 .014 .016 .016 .011 .0082 0 0 |
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Oh2 .3322 0 .6388 .013 .014 .014 .013 .0070 -.0003 0 |
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O4 1/3 2/3 .3462 .014 .014 .014 .014 .0073 0 0 |
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H1 0 0 .219 .038 |
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H2 .356 0 .750 .038 |
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|
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Cronstedtite |
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Hybler J |
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European Journal of Mineralogy 18 (2006) 197-205 |
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Parallel intergrowths in cronstedtite-1T: |
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determination of the degree of disorder |
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Locality: Roznava, Slovakia |
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Sample: ROZ |
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Note: 1T polytype |
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_database_code_amcsd 0007147 |
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5.501 5.501 7.106 90 90 120 P31m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeM1 .6654 0 .5 .0111 .0099 .0099 .0136 .0050 .0001 0 |
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SiT1 1/3 2/3 .1029 .78 .0126 .0142 .0142 .0094 .0071 0 0 |
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FeT1 1/3 2/3 .1029 .22 .0126 .0142 .0142 .0094 .0071 0 0 |
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O1 .448 0 .026 .039 .051 .045 .018 .022 .000 0 |
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Oh1 0 0 .353 .017 .022 .022 .008 .011 0 0 |
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Oh2 .333 0 .641 .016 .016 .017 .014 .008 .001 0 |
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O4 1/3 2/3 .349 .018 .020 .020 .014 .010 0 0 |
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H1 0 0 .205 .038 |
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H2 .332 0 .755 .038 |
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|
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| |
|
Cronstedtite |
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Hybler J |
| |
European Journal of Mineralogy 18 (2006) 197-205 |
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Parallel intergrowths in cronstedtite-1T: |
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determination of the degree of disorder |
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Locality: Litosice, Czech Republic |
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Sample: LIT |
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Note: 1T polytype |
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_database_code_amcsd 0007148 |
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5.490 5.490 7.086 90 90 120 P31m |
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atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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FeM1 .6651 0 .5 .0121 .0051 .0052 .0260 .0026 -.0002 0 |
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SiT1 1/3 2/3 .1021 .74 .0103 .0082 .0082 .014 .0041 0 0 |
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FeT1 1/3 2/3 .1021 .26 .0103 .0082 .0082 .014 .0041 0 0 |
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O1 .444 0 .023 .038 .041 .032 .040 .016 -.003 0 |
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Oh1 0 0 .348 .019 .013 .013 .029 .007 0 0 |
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Oh2 .332 0 .6402 .014 .012 .013 .016 .006 -.001 0 |
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O4 1/3 2/3 .342 .021 .013 .013 .037 .007 0 0 |
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H1 0 0 .234 .038 |
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H2 .400 0 .796 .038 |
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|
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Kettnerite |
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Hybler J, Dusek M |
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European Journal of Mineralogy 19 (2007) 411-418 |
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Revision of the crystal structure of kettnerite CaBi[OFCO3] |
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Locality: Krupka, Czech Republic |
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_database_code_amcsd 0007224 |
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5.3641 5.3641 13.5771 90 90 90 Pbaa |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Ca .25 0 .4002 .008 .010 .003 .009 .001 0 0 |
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Bi .25 0 .09429 .0117 .0127 .0124 .0101 .0008 0 0 |
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F .019 .25 .5 .005 |
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C .25 .5 .2555 .016 |
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O1 .003 .25 0 .005 |
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O2 .25 .5 .1609 .021 |
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O3 .383 .344 .2990 .009 |
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|
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Krupkaite |
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Synecek V, Hybler J |
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Neues Jahrbuch fur Mineralogie, Monatshefte 1974 (1974) 541-560 |
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The crystal structures of krupkaite, CuPbBi3S6, and of gladite, CuPbBi5S9, |
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and the classification of superstructures in the bismuthinite-aikinite group, |
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Locality: Krupka, Ore Mountains, NW-Bohemia |
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_database_code_amcsd 0014750 |
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11.15 11.51 4.01 90 90 90 *Pb2_1m |
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.25 0 .25 |
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atom x y z |
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Cu .194 .249 .25 |
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Bi(A1) .669 .033 .25 |
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Bi(A2) .184 .491 .75 |
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Bi(B1) .958 .162 .75 |
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Pb(B2) .498 .336 .25 |
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S(1,1) .624 .451 .75 |
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S(1,2) .106 .059 .25 |
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S(2.1) .606 .108 .75 |
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S(2,2) .046 .394 .25 |
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S(3,1) .784 .227 .25 |
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S(3,2) .314 .299 .75 |
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|
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Gladite |
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Synecek V, Hybler J |
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Neues Jahrbuch fur Mineralogie, Monatshefte 1974 (1974) 541-560 |
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The crystal structures of krupkaite, CuPbBi3S6, and of gladite, CuPbBi5S9, |
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and the classification of superstructures in the bismuthinite-aikinite group, |
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Locality: Krupka, Ore Mountains, NW-Bohemia |
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_database_code_amcsd 0014751 |
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33.62 11.48 4.00 90 90 90 Pbnm |
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atom x y z |
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Bi(Al) .228 .020 .25 |
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Bi(A2) .057 .480 .75 |
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Bi(A3) .392 .485 .75 |
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Bi(B1) .155 .352 .25 |
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Bi(B2) .487 .343 .25 |
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Pb(B3) .334 .185 .75 |
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S(1,1) .046 .504 .25 |
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S(1,2) .213 .460 .75 |
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S(1,3) .379 .058 .25 |
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S(2,1) .017 .364 .25 |
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S(2,2) .185 .129 .75 |
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S(2,3) .348 .382 .25 |
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S(3,1) .104 .275 .75 |
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S(3,2) .274 .233 .25 |
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S(3,3) .438 .280 .75 |
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Cu .235 .280 .75 |
|
|
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|
| |
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