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Xitieshanite |
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Jingliang Z, Li J, Wei D |
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Kexue Tongbao 33 (1988) 502-505 |
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The crystal structure of xitieshanite |
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Locality: Xitieshan, Quinghai Province, China |
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_database_code_amcsd 0019142 |
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10.6776 6.9148 14.1193 90 111.407 90 P2_1/c |
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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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Fe .25334 .67909 .54807 .0192 .0200 .0213 .0172 -.0019 .0076 .0008 |
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S .26091 .33852 .71286 .0192 .0202 .0192 .0186 -.0009 .0075 .0008 |
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Cl .20641 .54097 .39524 .0355 .0358 .0490 .0220 -.0004 .0110 -.0088 |
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Wat1 .05110 .70345 .52517 .0300 .0227 .0378 .0322 -.0035 .0130 -.0102 |
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Wat2 .24622 .95530 .49868 .0313 .0272 .0281 .0318 -.0037 .0028 .0113 |
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Wat3 .45179 .68002 .57695 .0339 .0187 .0577 .0247 -.0015 .0071 .0092 |
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Wat4 .28858 .80701 .68854 .0321 .0435 .0286 .0266 -.0022 .0159 -.0054 |
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O5 .27757 .42920 .62127 .0295 .0542 .023 .0178 -.0003 .0208 .0027 |
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Wat6 .47050 .17539 .56945 .0320 .0293 .0362 .0348 -.003 .0168 -.0015 |
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O7 .35369 .17456 .74011 .0252 .0236 .0212 .0262 -.0020 .0036 -.0017 |
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O8 .12202 .27550 .68387 .0328 .0187 .0370 .0408 -.0047 .0087 .0014 |
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O9 .29686 .47974 .79557 .0265 .0372 .0266 .0168 -.0006 .0111 -.0035 |
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Wat10 .02671 .08015 .34513 .0325 .0281 .0400 .0301 .0002 .0116 -.0018 |
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View JMOL 3-D Structure (permalink) |
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