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Aschamalmite |
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Callegari A M, Boiocchi M |
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Mineralogical Magazine 73 (2009) 83-94 |
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Aschamalmite (Pb6Bi2S9): crystal structure and ordering scheme for Pb and Bi atoms |
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Locality: Susa Valley, Piedmont, Italy |
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_database_code_amcsd 0014588 |
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13.719 4.132 31.419 90 90.94 90 C2/m |
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atom x y z occ Uiso |
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PbMe1 .4215 0 .2462 .0364 |
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PbMe2A .5 0 0 .76 .0149 |
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BiMe2A .5 0 0 .24 .0149 |
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PbMe2B .5 0 .5 .86 .0145 |
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BiMe2B .5 0 .5 .14 .0145 |
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PbMe3A .2298 0 .0580 .0163 |
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PbMe3B .2279 0 .4419 .99 .0152 |
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BiMe3B .2279 0 .4419 .01 .0152 |
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BiMe4A .6883 0 .1749 .61 .0175 |
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PbMe4A .6883 0 .1749 .39 .0175 |
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BiMe4B .6773 0 .3253 .84 .0172 |
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PbMe4B .6773 0 .3253 .16 .0172 |
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PbMe5A .9601 0 .1188 .62 .0163 |
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BiMe5A .9601 0 .1188 .38 .0163 |
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BiMe5B .9523 0 .3803 .73 .0140 |
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PbMe5B .9523 0 .3803 .27 .0140 |
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S1A .0552 0 .1948 .0205 |
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S1B .0381 0 .3047 .0249 |
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S2A .5891 0 .0858 .0198 |
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S2B .5812 0 .4132 .0199 |
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S3 .7814 0 .2491 .0195 |
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S4A .3291 0 .1474 .0213 |
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S4B .3240 0 .3564 .0232 |
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S5A .8614 0 .0265 .0192 |
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S5B .8600 0 .4718 .0161 |
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Capranicaite |
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Callegari A M, Boiocchi M, Bellatreccia F, Caprilli E, Medenbach O, Cavallo A |
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Mineralogical Magazine 75 (2011) 33-43 |
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Capranicaite, (K,_)(Ca,Na)Al4B4Si2O18: a new inosilicate from Capranica, |
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Italy, with a peculiar topology of the periodic single chain [Si2O6] |
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Locality: Vico volcanic complex, Capranica, Viterbo Province, Latium, Italy |
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_database_code_amcsd 0018373 |
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4.8507 16.6156 20.5445 90 90.245 90 P2_1/n |
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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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Si1 .8024 .8570 .2496 .0160 .0155 .0198 .0126 -.0027 .0007 .0000 |
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Si2 .1980 .4693 .2506 .0151 .0135 .0187 .0129 -.0015 .0002 .0000 |
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Al1 .2517 .5357 .3947 .0099 .0083 .0100 .0115 -.0001 .0002 -.0002 |
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Al2 .2483 .5357 .1058 .0099 .0080 .0101 .0116 -.0002 .0001 .0005 |
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Al3 .7544 .7945 .1044 .0107 .0116 .0083 .0122 -.0003 .0005 -.0003 |
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Al4 .7456 .7951 .3954 .0106 .0115 .0083 .0118 -.0007 .0010 .0003 |
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B1 .2542 .7072 .0809 .0155 .0067 .0057 .0343 -.0003 .0002 -.0011 |
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B2 .2457 .7074 .4186 .0166 .0051 .0040 .0408 .0012 .0003 .0000 |
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B3 .7489 .4582 .4295 .0105 .0107 .0111 .0097 .0006 .0002 -.0008 |
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B4 -.2496 .4584 .0703 .0116 .0102 .0103 .0142 -.0001 .0003 .0004 |
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CaM1 .7377 .6289 .0037 .60 .0138 .0140 .0131 .0144 .0000 .0002 -.0001 |
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NaM1 .7377 .6289 .0037 .40 .0138 .0140 .0131 .0144 .0000 .0002 -.0001 |
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CaM2 .2395 .3706 .5038 .61 .0134 .0134 .0125 .0142 .0001 -.0001 -.0001 |
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NaM2 .2395 .3706 .5038 .39 .0134 .0134 .0125 .0142 .0001 -.0001 -.0001 |
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KA .7125 .6337 .2500 .72 .0600 .0587 .0243 .0970 -.0056 .0076 .0015 |
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CsA .7125 .6337 .2500 .07 .0600 .0587 .0243 .0970 -.0056 .0076 .0015 |
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O1 .6193 .9387 .2484 .0304 .0136 .0288 .0487 .0007 .0011 .0016 |
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O2 .1196 .8883 .2496 .0309 .0148 .0249 .0529 -.0020 .0012 .0007 |
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O3 .7474 .8015 .1873 .0285 .0396 .0323 .0135 -.0067 -.0005 -.0032 |
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O4 .7459 .8033 .3126 .0290 .0361 .0359 .0149 -.0067 .0005 .0038 |
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O5 .2490 .5250 .1883 .0284 .0396 .0322 .0135 -.0049 -.0002 .0051 |
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O6 .2570 .5256 .3121 .0289 .0392 .0343 .0132 -.0082 .0012 -.0031 |
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O7 .5277 .7173 .4212 .0166 .0099 .0113 .0286 -.0008 -.0001 .0040 |
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O8 .4265 .7727 .0724 .0164 .0128 .0118 .0245 -.0031 -.0022 .0045 |
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O9 .9724 .7173 .0774 .0169 .0104 .0105 .0298 .0008 -.0006 -.0034 |
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O10 .0730 .7729 .4273 .0172 .0130 .0127 .0257 .0032 -.0015 -.0046 |
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O11 .0314 .4656 .4312 .0144 .0095 .0113 .0223 .0000 .0006 .0033 |
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O12 -.0836 .5250 .0727 .0154 .0107 .0100 .0256 -.0017 -.0035 .0025 |
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O13 .4690 .4660 .0690 .0155 .0090 .0123 .0252 .0005 .0000 -.0039 |
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O14 .5844 .5251 .4275 .0160 .0102 .0119 .0259 .0015 -.0026 -.0018 |
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O15 .6346 .8830 .4346 .0169 .0137 .0094 .0276 -.0016 .0059 -.0023 |
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O16 .8666 .8830 .0662 .0162 .0144 .0083 .0259 .0018 .0051 .0015 |
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O17 .1332 .6311 .4179 .0172 .0115 .0093 .0310 -.0013 .0025 -.0010 |
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O18 .3680 .6313 .0836 .0180 .0115 .0111 .0313 .0004 .0023 .0017 |
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Coralloite |
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Callegari A M, Boiocchi M, Ciriotti M E, Balestra C |
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American Mineralogist 97 (2012) 727-734 |
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Coralloite, Mn2+Mn3+2(AsO4)2(OH)2*4H2O, a new mixed valence Mn hydrate arsenate: |
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crystal structure and relationships with bermanite and whitmoreite mineral groups |
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Locality: Monte Nero mine, Rocchetta Vara, La Spezia, Liguria, Italy |
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_database_code_amcsd 0018861 |
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5.5828 9.7660 5.5455 94.467 111.348 93.850 P1 |
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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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Mn3+M1 0 0 0 .0113 .0084 .0146 .0117 .0034 .0044 .0010 |
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Mn3+M2 .5006 .0047 .4997 .0107 .0081 .0143 .0107 .0037 .0042 .0009 |
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Mn2+M3 .1697 .5046 .3445 .0167 .0175 .0165 .0193 .0033 .0104 .0022 |
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As1 .0643 .1933 .5121 .0109 .0100 .0126 .0120 .0029 .0061 .0014 |
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As2 -.0661 .8037 .4850 .0121 .0100 .0138 .0141 .0029 .0064 .0012 |
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O1 -.0734 .1508 .1866 .0114 .0133 .0119 .0084 .0078 .0026 -.0002 |
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O2 .0608 .8431 .8124 .0160 .0128 .0242 .0141 .0066 .0077 .0031 |
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O3 -.1079 .1081 .6569 .0166 .0138 .0223 .0147 -.0039 .0080 .0004 |
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O4 .1118 .8912 .3496 .0146 .0100 .0172 .0190 .0004 .0080 .0039 |
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O5 .3748 .1571 .6328 .0164 .0153 .0156 .0176 .0047 .0054 -.0012 |
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O6 .6282 .8512 .3668 .0125 .0053 .0205 .0101 .0050 .0012 -.0031 |
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O7 .0459 .3631 .5591 .0165 .0261 .0083 .0222 .0025 .0160 .0082 |
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O8 -.0853 .6376 .4180 .0208 .0083 .0225 .0301 .0040 .0061 -.0030 |
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OH1 .3683 .0667 .1556 .0123 .0078 .0207 .0099 .0015 .0058 -.0015 |
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OH2 .6237 .9414 -.1536 .0130 .0077 .0188 .0136 .0032 .0042 .0058 |
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Wat1 .4615 .3745 .2708 .0348 .0307 .0383 .0492 .0150 .0259 .0208 |
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Wat2 .2816 .6416 .1007 .0187 .0170 .0204 .0179 .0029 .0053 .0028 |
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Wat3 -.1225 .4105 -.0471 .0241 .0220 .0241 .0281 .0021 .0131 -.0048 |
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Wat4 .4961 .6011 .7240 .0349 .0298 .0409 .0313 -.0036 .0103 -.0012 |
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|
| Download AMC data (View Text File)
Download CIF data (View Text File)
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View JMOL 3-D Structure
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