Bezou C, Nonat A, Mutin J C, Christensen A N, Lehmann M S
Journal of Solid State Chemistry 117 (1995) 165-176
Of the crystal structure of gamma-CaSO4, CaSO4*0.5(H2O), and CaSO4*0.6(H2O)
by powder diffraction methods
Locality: Maurienne, France
Sample: SH1, X-ray diffraction
_database_code_amcsd 0013867
12.0317 6.9272 12.6711 90 90.27 90 I2
atom x y z Biso
Ca1 0 .003 .5 .5
Ca2 .720 .164 .158 .5
Ca3 .263 .206 .336 .4
Ca4 0 0 0 .3
S2 .001 .003 .254 .8
S3 .724 .172 .418 .8
S4 .275 .183 .086 .9
O11 .076 .144 .309 1.0
O12 .066 -.130 .186 .9
O21 -.069 .108 .176 1.0
O22 -.063 -.111 .331 .9
O31 .737 .306 .330 .9
O32 .635 .227 .495 1.0
O33 .824 .157 .485 1.0
O34 .700 -.016 .365 1.0
O41 .236 .349 .147 1.1
O42 .378 .241 .028 .6
O43 .196 .099 .009 .7
O44 .300 .043 .169 .8
Wat2 .044 .481 .650 2.5
Wat1 0 .347 0 2.2
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