Mandarinoite Hawthorne F C The Canadian Mineralogist 22 (1984) 475-480 The crystal structure of mandarinoite, Fe2Se3O9.6H2O _database_code_amcsd 0005198 16.810 7.880 10.019 90 98.26 90 P2_1/c atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3) Se1 .9814 .0402 .3157 .0012 .0035 .0018 -.0001 .0003 .0002 Se2 .2232 .7278 .7296 .0012 .0037 .0019 -.0001 .0001 .0004 Se3 .5277 .4819 .8133 .0011 .0042 .0017 .0001 .0003 .0001 Fe1 .3992 .7447 .9105 .0011 .0033 .0019 .0001 .0004 .0003 Fe2 .9056 .2408 .0462 .0012 .0039 .0012 .0000 .0002 .0000 O1 .9804 .2132 .4165 .0010 .0055 .0026 -.0003 .0004 -.0028 O2 .0778 -.0288 .3678 .0012 .0058 .0024 .0000 -.0004 .0010 O3 .9993 .1372 .1715 .0017 .0095 .0016 -.0004 .0014 .0001 O4 .3144 -.1765 .7662 .0008 .0079 .0021 -.0005 -.0004 .0007 O5 .1916 -.1686 .5793 .0021 .0054 .0013 -.0007 .0001 .0004 O6 .1688 -.1602 .8291 .0019 .0062 .0030 -.0003 .0019 -.0028 O7 .5206 .3855 .6606 .0020 .0055 .0004 .0004 -.0002 -.0003 O8 .4301 .5483 .8012 .0010 .0049 .0017 .0018 .0004 .0002 O9 .4777 .6841 .0774 .0020 .0062 .0011 .0007 .0002 .0023 O10 .3162 -.4275 .9668 .0022 .0078 .0024 .0002 .0010 .0013 O11 .3560 -.0759 .0322 .0017 .0046 .0020 .0001 -.0005 .0020 O12 .8857 .0073 -.0482 .0017 .0048 .0045 -.0006 .0009 -.0015 O13 .6401 .7601 .0739 .0017 .0110 .0054 -.0006 .0003 -.0002 O14 .2525 .3129 .2005 .0076 .0063 .0077 -.0006 .0031 .0016 O15 .1779 .2416 .4283 .0026 .0092 .0061 -.0016 .0009 -.0007 H1 .27 .56 .93 1.0 H2 .35 .49 .97 1.0 H3 .39 .92 .12 1.0 H4 .37 -.01 .99 1.0 H5 .06 -.05 .06 1.0 H6 .11 .13 .05 1.0 H7 .41 .28 .41 1.0 H8 .23 .2 .57 1.0 H9 .28 .39 .19 1.0 H10 .15 .10 .37 1.0 H11 .18 .31 .35 1.0