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Whiteite-(MnMnMg) |
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Elliott P, Willis A C |
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The Canadian Mineralogist 57 (2019) 215-223 |
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Whiteite-(MnMnMg), a new jahnsite-group mineral from Iron Monarch, South Australia: |
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Description and crystal structure |
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Note: Not all hydrogens were located |
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Locality: Iron Monarch quarry, Iron Knob, South Australia, Australia |
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_database_code_amcsd 0020863 |
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15.0357 6.9408 9.9431 90 110.827 90 P2/a |
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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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MnX .25 .96332 0 .57 .0193 .0191 .0114 .0208 0 -.0013 0 |
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CaX .25 .96332 0 .39 .0193 .0191 .0114 .0208 0 -.0013 0 |
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NaX .25 .96332 0 .03 .0193 .0191 .0114 .0208 0 -.0013 0 |
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KX .25 .96332 0 .01 .0193 .0191 .0114 .0208 0 -.0013 0 |
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Mn2+M1 .25 .46379 0 .92 .0119 .0134 .0114 .0128 0 .0069 0 |
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MgM1 .25 .46379 0 .08 .0119 .0134 .0114 .0128 0 .0069 0 |
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Mg1M2a .5 0 .5 .0061 .0058 .0047 .0072 -.0031 .0015 -.0003 |
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Mg2M2b .25 .50254 .5 .0053 .0057 .0058 .0053 0 .0030 0 |
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Al1M3a 0 0 0 .91 .0061 .0067 .0027 .0096 .0003 .0037 .0009 |
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Mn3+1M3a 0 0 0 .09 .0061 .0067 .0027 .0096 .0003 .0037 .0009 |
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Al2M3b 0 .5 0 .91 .0053 .0058 .0025 .0088 .0004 .0040 .0008 |
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Mn3+2M3b 0 .5 0 .08 .0053 .0058 .0025 .0088 .0004 .0040 .0008 |
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P1 .17761 .25464 .18935 .0120 .0128 .0117 .0118 -.0005 .0050 .0003 |
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P2 .08209 .74881 .80415 .0111 .0113 .0110 .0117 .0019 .0050 .0012 |
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O1 .26524 .2062 .1480 .0260 .0175 .0400 .0243 .0092 .0122 .0107 |
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O2 .20714 .2949 .3480 .0222 .0357 .0168 .0132 -.0028 .0074 -.0013 |
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O3 .10982 .0832 .1505 .0244 .0259 .0102 .0262 .0023 -.0043 -.0029 |
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O4 .13398 .4327 .0933 .0143 .0140 .0101 .0187 .0012 .0055 -.0008 |
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O5 .18921 .6944 .8555 .0184 .0130 .0241 .0177 .0038 .0048 .0033 |
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O6 .04660 .7830 .6426 .0170 .0190 .0177 .0128 .0043 .0039 .0021 |
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O7 .08062 .9323 .8916 .0191 .0285 .0103 .0245 -.0002 .0168 -.0028 |
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O8 .02511 .5859 .8379 .0152 .0207 .0100 .0182 .0003 .0109 -.0003 |
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OH9 .02159 .7501 .0851 .0124 .0141 .0080 .0153 .0001 .0054 -.0003 |
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OW10 .22716 .7279 .3441 .0249 .0343 .0242 .0215 .0035 .0163 .0075 |
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OW11 .4464 .2178 .3433 .0308 .0395 .0164 .0226 -.0008 -.0059 -.0034 |
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OW12 .63093 .9986 .4694 .0260 .0222 .0222 .0368 -.0126 .0143 -.0055 |
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OW13 .39149 .5151 .5129 .0221 .0174 .0179 .0314 .0050 .0092 -.0002 |
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H10a .234 .725 .263 .05 |
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H11a .391 .198 .270 .05 |
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H11b .422 .316 .384 .05 |
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H12a .648 .905 .433 .05 |
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H12b .675 .053 .528 .05 |
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H13a .414 .601 .473 .05 |
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H13b .423 .473 .581 .05 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Whiteite-(CaFeMg) |
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Capitelli F, Chita G, Cavallo A, Bellatreccia F, Ventura G |
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Zeitschrift fur Kristallographie 226 (2011) 731-738 |
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Crystal structure of whiteite-(CaFeMg) from Crosscut Creek, Canada |
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Locality: Crosscut Creek, Yukon, Canada |
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_database_code_amcsd 0019137 |
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14.8700 6.9785 9.9268 90 110.110 90 P2/a |
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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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CaX .25 -.02734 0 .95 .0214 .0209 .0120 .0235 0 -.0023 0 |
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NaX .25 -.02734 0 .11 .0214 .0209 .0120 .0235 0 -.0023 0 |
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FeM1 .25 .47421 0 .900 .01315 .0137 .0128 .0132 0 .00495 0 |
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MgM2 .25 .49738 .5 1.005 .0138 .0143 .0147 .0128 0 .0052 0 |
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MgM2 .5 0 .5 1.005 .0145 .0143 .0137 .0145 -.0005 .0036 -.0032 |
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AlM3 0 0 0 1.024 .01103 .0108 .0098 .0125 -.0001 .0040 -.0005 |
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AlM3 0 .5 0 1.024 .01178 .0113 .0110 .0132 .0002 .0046 .0009 |
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P1 .18055 .26402 .18581 .01164 .0110 .0126 .0108 .00045 .00318 -.00027 |
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P2 .07936 .74556 .80031 .01090 .0111 .0115 .0104 .00069 .00418 .00077 |
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O1 .27407 .2383 .15106 .0212 .0147 .0296 .0209 .0072 .0080 .0047 |
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O2 .20254 .29773 .34383 .0193 .0259 .0187 .0122 -.0016 .0052 -.0017 |
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O3 .12060 .08277 .13629 .0207 .0210 .0130 .0207 -.0023 -.0022 .0005 |
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O4 .13388 .43949 .08982 .0141 .0115 .0134 .0168 .0002 .0040 .0022 |
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O5 .18806 .69414 .85668 .0166 .0125 .0203 .0167 .0026 .0047 .0020 |
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O6 .04783 .77900 .63964 .0166 .0206 .0164 .0119 .0027 .0046 .0020 |
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O7 .07267 .93135 .88071 .0164 .0210 .0126 .0200 -.0014 .0123 -.0023 |
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O8 .02133 .58442 .83365 .0145 .0169 .0126 .0156 -.0016 .0076 .0005 |
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O9 .02239 .75174 .08286 .997 .0134 .0150 .0113 .0144 -.0002 .0055 0 |
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H9 .0020 .743 .1625 .997 .020 |
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O10 .22535 .7224 .34460 1.022 .0291 .0399 .0275 .0247 .0111 .0173 .0063 |
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H10a .1738 .732 .2573 1.022 .044 |
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H10b .2562 .726 .276 1.022 .036 |
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O11 .45119 .2146 .34572 1.009 .0328 .0395 .0216 .0236 -.0037 -.0069 .0003 |
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H11a .430 .299 .403 1.009 .049 |
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H11b .400 .207 .258 1.009 .090 |
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O12 .63087 -.0041 .46625 1.035 .0313 .0243 .0288 .0442 -.0045 .0160 -.0129 |
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H12a .6839 .049 .537 1.035 .047 |
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H12b .651 -.106 .421 1.035 .067 |
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O13 .39021 .5129 .50859 1.019 .0253 .0185 .0263 .0326 .0002 .0107 .0075 |
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H13a .4323 .467 .5950 1.019 .038 |
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H13b .416 .601 .459 1.019 .082 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Whiteite-(CaMnMn) |
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Grey I E, Mumme W G, Neville S M, Wilson N C, Birch W D |
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Mineralogical Magazine 74 (2010) 969-978 |
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Jahnsite - whiteite solid solutions and associated minerals in |
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the phosphate pegmatite at Hagendorf-Sud, Bavaria, Germany |
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Locality: Hagendorf-Sud, Bavaria, Germany |
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_database_code_amcsd 0018316 |
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14.941 6.9495 10.054 90 111.00 90 P2/a |
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atom x y z occ Uiso |
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CaX .25 .9770 0 1.18 .032 |
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MnM1 .25 .4798 0 .0150 |
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FeM2a .5 0 .5 .86 .0203 |
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MgM2a .5 0 .5 .14 .0203 |
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FeM2b .25 .4966 .5 .85 .0188 |
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MgM2b .25 .4966 .5 .15 .0188 |
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AlM3a 0 0 0 .80 .032 |
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FeM3a 0 0 0 .20 .032 |
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AlM3b 0 .5 0 .96 .007 |
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FeM3b 0 .5 0 .04 .007 |
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P1 .1786 .2574 .1859 .0167 |
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P2 .0793 .7489 .8035 .0148 |
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O1 .2707 .2319 .1503 .028 |
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O2 .2007 .2870 .3415 .030 |
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O3 .1178 .0771 .1342 .038 |
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O4 .1315 .4353 .0956 .028 |
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O5 .1879 .7087 .8547 .031 |
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O6 .0420 .7766 .6450 .021 |
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O7 .0681 .9307 .8809 .028 |
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O8 .0282 .5867 .8407 .025 |
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OH9 .0222 .7506 .0792 .015 |
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Wat10 .2255 .7314 .3413 .040 |
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Wat11 .4532 .2157 .3393 .036 |
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Wat12 .6364 .9984 .4769 .036 |
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Wat13 .3955 .5121 .5074 .034 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Whiteite-(CaMnMn) |
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Yakovenchuk V N, Keck E, Krivovichev S V, Pakhomovsky Y A, Selivanova E A, |
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Mikhailova J A, Chernyatieva A P, Ivanyuk G Y |
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Mineralogical Magazine 76 (2012) 2761-2771 |
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Whiteite-(CaMnMn), CaMnMn2Al2[PO4]4(OH)2*8H2O, a new mineral from the |
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Hagendorf-Sud granitic pegmatite, Germany |
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Locality: Hagendorf-Sud granitic pegmatite, Germany |
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_database_code_amcsd 0019707 |
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15.020 6.959 10.137 90 111.740 90 P2/a |
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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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CaX .25 .9757 0 .93 .0216 .0293 .0082 .0230 0 .0046 0 |
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ZnX .25 .9757 0 .07 .0216 .0293 .0082 .0230 0 .0046 0 |
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MnM1 .25 .4788 0 .99 .0185 .0300 .0111 .0149 0 .0088 0 |
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MgM1 .25 .4788 0 .01 .0185 .0300 .0111 .0149 0 .0088 0 |
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MnM2a .5 0 .5 .97 .0156 .0300 .0111 .0149 0 .0088 0 |
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MgM2a .5 0 .5 .03 .0156 .0300 .0111 .0149 0 .0088 0 |
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MnM2b .25 .49571 .5 .0167 .0158 .0122 .0177 .0007 .0049 -.0068 |
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AlM3a 0 0 0 .87 .0125 .0164 .0153 .0190 0 .0073 0 |
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FeM3a 0 0 0 .13 .0125 .0164 .0153 .0190 0 .0073 0 |
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AlM3b 0 .5 0 .97 .0135 .0209 .0071 .0090 -.0003 .0050 .0021 |
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FeM3b 0 .5 0 .03 .0135 .0209 .0071 .0090 -.0003 .0050 .0021 |
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P1 .17754 .25640 .18605 .0153 .012 .0105 .0210 .0014 .0091 .0023 |
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P2 .07970 .74922 .80459 .0121 .0151 .0116 .0165 .0014 .0029 -.0018 |
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O1 .2686 .2298 .1494 .0336 .0178 .0073 .0124 .0029 .0070 .0014 |
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O2 .2016 .2839 .3424 .0218 .027 .047 .031 .016 .0158 .009 |
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O3 .1174 .0786 .1357 .0434 .025 .0218 .020 -.003 .0092 -.008 |
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O4 .1317 .4351 .0961 .0242 .053 .0077 .041 -.006 -.016 .0004 |
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O5 .1890 .7085 .8560 .0318 .025 .0142 .0281 .002 .0036 .0043 |
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O6 .0456 .7738 .6450 .0206 .025 .038 .027 .007 .0037 .0060 |
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O7 .0709 .9340 .8817 .0341 .027 .0210 .0102 -.001 .0021 .0008 |
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O8 .0279 .5817 .8423 .0276 .067 .0085 .040 -.000 .036 .0002 |
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OH9 .0206 .7508 .0798 .0126 .051 .0106 .028 -.002 .0226 -.003 |
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Wat10 .2200 .7290 .3391 .0358 .0141 .0062 .0153 -.0001 .0031 -.0003 |
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Wat11 .4496 .2205 .3388 .0364 .048 .024 .029 .005 .006 .0017 |
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Wat12 .6353 .9975 .4773 .0354 .039 .024 .025 -.006 -.013 -.002 |
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Wat13 .3940 .5121 .5099 .0311 .023 .030 .059 -.006 .022 -.012 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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