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Medenbachite |
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Krause W, Bernhardt H J, Gebert W, Graetsch H, Belendorff K, Petitjean K |
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American Mineralogist 81 (1996) 505-512 |
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Medenbachite, Bi2Fe(Cu,Fe)(O,OH)2(OH)2(AsO4)2, a new mineral species: Its |
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description and crystal structure |
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Sample: 8.0.376, single Bi atom model |
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_database_code_amcsd 0001790 |
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4.581 6.178 8.969 94.29 99.93 94.85 P-1 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Bi .2077 .3114 .3917 .0815 .0287 .0275 .0213 -.0152 .0023 |
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Fe1 0 0 0 .0197 .0205 .0297 .0009 .0019 .0095 |
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Cu2 0 .5 0 .88 .0202 .0179 .0262 .0008 .0012 .0102 |
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Fe2 0 .5 0 .12 .0202 .0179 .0262 .0008 .0012 .0102 |
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As .5411 .7998 .2178 .0205 .0209 .0254 .0006 .0006 .0096 |
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O1 .314 .565 .198 .0217 .020 .031 -.004 .002 .012 |
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O2 .145 .742 .899 .009 .028 .034 -.005 -.003 .013 |
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O3 .338 .012 .182 .025 .020 .037 .002 -.008 .004 |
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O4 .245 .224 .916 .019 .021 .031 .002 .010 .004 |
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O5 .277 .617 .541 .018 .032 .045 -.001 -.002 -.008 |
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O6 .246 .139 .611 .033 .039 .025 .001 -.006 .009 |
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Medenbachite |
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Krause W, Bernhardt H J, Gebert W, Graetsch H, Belendorff K, Petitjean K |
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American Mineralogist 81 (1996) 505-512 |
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Medenbachite, Bi2Fe(Cu,Fe)(O,OH)2(OH)2(AsO4)2, a new mineral species: Its |
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description and crystal structure |
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Sample: 8.0.376, split Bi atom model |
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_database_code_amcsd 0001791 |
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4.581 6.178 8.969 94.29 99.93 94.85 P-1 |
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atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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Bi1 .1589 .2996 .3953 .5 .0221 .0249 .0257 .0028 -.0060 .0044 |
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Bi2 .2541 .3223 .3883 .5 .0190 .0208 .0274 .0006 -.0054 .0063 |
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Fe1 0 0 0 .0197 .0205 .0297 .0009 .0019 .0095 |
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Cu2 0 .5 0 .88 .0202 .0179 .0262 .0008 .0012 .0102 |
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Fe2 0 .5 0 .12 .0202 .0179 .0262 .0008 .0012 .0102 |
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As .5411 .7998 .2178 .0205 .0209 .0254 .0006 .0006 .0096 |
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O1 .314 .565 .198 .0217 .020 .031 -.004 .002 .012 |
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O2 .145 .742 .899 .009 .028 .034 -.005 -.003 .013 |
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O3 .338 .012 .182 .025 .020 .037 .002 -.008 .004 |
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O4 .245 .224 .916 .019 .021 .031 .002 .010 .004 |
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O5 .277 .617 .541 .018 .032 .045 -.001 -.002 -.008 |
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O6 .246 .139 .611 .033 .039 .025 .001 -.006 .009 |
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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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Ferrilotharmeyerite |
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Krause W, Belendorff K, Bernhardt H J, McCammon C A, Effenberger H, Mikenda W |
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European Journal of Mineralogy 10 (1998) 179-206 |
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Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, |
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tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite |
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_database_code_amcsd 0006708 |
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9.010 6.246 7.391 90 115.52 90 C2/m |
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atom x y z occ Biso |
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CaMe1 0 0 0 .92 |
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FeMe2 .25 .25 .5 .497 .73 |
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ZnMe2 .25 .25 .5 .503 .73 |
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AsX .91466 .5 .20451 .60 |
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OH1 .3439 .5 .4083 .92 |
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O2 .3183 0 .3621 1.12 |
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O3 .0339 .2798 .2453 .89 |
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O4 .2429 .5 .0206 1.24 |
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Thometzekite |
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Krause W, Belendorff K, Bernhardt H J, McCammon C A, Effenberger H, Mikenda W |
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European Journal of Mineralogy 10 (1998) 179-206 |
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Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, |
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tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite |
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_database_code_amcsd 0006709 |
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9.077 6.300 7.661 90 116.99 90 C2/m |
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atom x y z occ Biso |
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PbMe1 0 0 0 2.38 |
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CuMe2 .25 .25 .5 1.44 |
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AsX .9167 .5 .2097 .617 1.45 |
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SX .9167 .5 .2097 .383 1.45 |
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OH1 .3426 .5 .4204 1.91 |
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O2 .3083 0 .3267 2.31 |
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O3 .0308 .2887 .2623 1.83 |
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O4 .2084 .5 .0180 2.82 |
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Mounanaite |
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Krause W, Belendorff K, Bernhardt H J, McCammon C A, Effenberger H, Mikenda W |
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European Journal of Mineralogy 10 (1998) 179-206 |
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Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, |
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tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite |
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_database_code_amcsd 0006710 |
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9.294 6.166 7.713 90 115.57 90 C2/m |
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atom x y z Biso |
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PbMe1 0 0 0 1.82 |
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FeMe2 .25 .25 .5 1.51 |
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VX .9228 .5 .2256 1.29 |
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F1 .3368 .5 .4183 1.43 |
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O2 .3185 0 .3722 2.00 |
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O3 .0406 .2729 .2663 1.40 |
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O4 .2125 .5 -.0053 1.72 |
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Gartrellite |
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Krause W, Belendorff K, Bernhardt H J, McCammon C A, Effenberger H, Mikenda W |
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European Journal of Mineralogy 10 (1998) 179-206 |
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Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, |
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tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite |
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_database_code_amcsd 0006711 |
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5.431 5.642 7.573 67.62 69.57 70.31 P-1 |
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atom x y z Biso |
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PbMe1 0 0 0 .07 |
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FeMe2 0 .5 .5 1.40 |
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CuMe2 .5 0 .5 1.40 |
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AsX .4100 .4347 .7920 1.00 |
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OH1 .146 .171 .4198 .62 |
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O2 .284 .306 .6702 .62 |
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O3a .251 .685 .2815 .62 |
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O3b .686 .230 .2723 .62 |
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O4 .261 .275 .0366 .62 |
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Helmutwinklerite |
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Krause W, Belendorff K, Bernhardt H J, McCammon C A, Effenberger H, Mikenda W |
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European Journal of Mineralogy 10 (1998) 179-206 |
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Crystal chemistry of the tsumcorite-group minerals. New data on ferrilotharmeyerite, |
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tsumcorite, thometzekite, mounanaite, helmutwinklerite, and a redefinition of gartrellite |
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_database_code_amcsd 0006712 |
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5.606 5.610 7.617 70.19 69.91 69.18 P-1 |
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atom x y z Biso |
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PbMe1 0 0 0 2.72 |
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Zn1 0 .5 .5 1.82 |
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Zn2 .5 0 .5 1.84 |
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AsX .42101 .42320 .77763 1.74 |
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OH1 .1554 .1572 .4059 3.10 |
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O2 .3131 .3093 .6509 1.89 |
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O3a .2495 .6831 .2581 2.56 |
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O3b .6842 .2471 .2610 2.42 |
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O4 .2786 .2874 .0085 5.03 |
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