Szaibelyite
Takeuchi Y, Kudoh Y
American Mineralogist 60 (1975) 273-279
Szaibelyite, Mq2(OH)[B2O4(OH)]: Crystal structure, pseudosymmetry, and
polymorphism
_database_code_amcsd 0000453
12.577 10.393 3.139 90 95.9 90 P2_1/a
atom x y z B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Mg1 .5047 .1372 .2348 .0016 .0013 .0215 .0001 .0028 .0002
Mg2 .4129 .4208 .7104 .0021 .0019 .0297 .0002 .0024 -.0014
B1 .1372 .1680 .7598 .0028 .0019 .0383 -.0010 .0029 .0010
B2 .3072 .0472 .6253 .0030 .0023 .0372 -.0005 .0033 .0014
O1 .0762 .0616 .7804 .0026 .0023 .0302 .0002 .0024 .0015
O2 .1012 .2908 .7750 .0029 .0022 .0379 -.0002 .0026 .0001
O3 .2476 .1548 .7208 .0031 .0030 .0450 0 .0016 -.0018
Oh4 .2481 .4485 .6078 .0034 .0025 .0379 .0000 .0019 .0043
O5 .4134 .0434 .7155 .0027 .0021 .3000 -.0002 .0015 .0001
Oh6 .4084 .2953 .2059 .0027 .0020 .0354 -.0004 .0020 .0006
H1 .21 .39 .66
H2 .33 .28 .10
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Szaibelyite
Grice J D
The Canadian Mineralogist 46 (2008) 671-677
Szaibelyite: Crystal structure analysis and hydrogen bonding
Locality: Penobsquis, Kings County, New Brunswick, Canada
_database_code_amcsd 0006191
12.586 10.415 3.1340 90 95.923 90 P2_1/a
atom x y z Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg1 .50433 .13724 .2348 .00791 .0074 .0071 .0092 .0002 .0006 -00001
Mg2 .41242 .42083 .7103 .00806 .0073 .0078 .0090 .0005 .0007 .0004
B1 .13788 .1681 .7590 .0079 .0077 .0083 .0073 .0006 .0007 .0005
B2 .30629 .0479 .6212 .0085 .0085 .0078 .0093 -.0008 .0013 .0012
O1 .07618 .06199 .7800 .0087 .0077 .0076 .0108 -00004 .0013 -00000
O2 .10053 .29133 .7743 .0089 .0084 .0067 .0116 .0005 .0013 .0000
O3 .24772 .15513 .7185 .0104 .0070 .0074 .0171 -00001 .0027 -.0015
O4 .24785 .44956 .6062 .0108 .0075 .0093 .0152 -.0004 .0003 .0036
O5 .41400 .04335 .7182 .0086 .0065 .0080 .0113 .0007 .0004 -.0004
O6 .40869 .29482 .2074 .0090 .0073 .0082 .0114 -00005 .0009 -.0000
H4 .197 .387 .679 .042
H6 .348 .266 .154 .028
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