Bottinoite Bonazzi P, Mazzi F American Mineralogist 81 (1996) 1494-1500 Bottinoite, Ni(H2O)6[Sb(OH)6]2: Crystal structure, twinning and hydrogen-bond model Sample: BS2, synthetic Note: U(1,2) for Sb1 and Sb3 changed to match symmetry constraints. _database_code_amcsd 0001841 16.060 16.060 9.792 90 90 120 P3 atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Sb1 0 0 0 .017 .017 .003 .0085 0 0 Sb2 2/3 1/3 -.0883 .010 .010 .006 .005 0 0 Sb3 1/3 2/3 -.0021 .005 .005 .042 .0025 0 0 Sb4 0 0 .4974 .014 .014 .002 .007 0 0 Sb5 2/3 1/3 .4185 .010 .010 .018 .005 0 0 Sb6 1/3 2/3 .4987 .008 .008 .018 .004 0 0 Sb7 .3283 -.0066 .4704 .008 .009 .018 .003 .001 .003 Sb8 .6678 .0055 .4496 .014 .014 .002 .008 -.001 0 Ni1 .3379 .0080 -.0311 .010 .005 .031 .004 .000 -.003 Ni2 .6639 -.0065 -.0505 .013 .020 .001 .009 -.001 -.004 O1 .032 .117 -.120 .028 .005 .058 .010 -.007 .005 O2 .114 .081 .112 .021 .046 .001 .003 -.004 .004 O3 .579 .221 -.200 .018 .012 .042 -.005 -.015 -.013 O4 .697 .254 .027 .015 .023 .006 .011 -.008 -.002 O5 .302 .554 .119 .017 .019 .007 .010 -.004 -.002 O6 .364 .783 -.109 .025 .011 .022 .017 -.001 -.001 O7 .315 .097 -.159 .043 .021 .030 .028 -.009 .000 O8 .426 .116 .093 .027 .029 .004 .018 -.002 -.005 O9 .454 .036 -.147 .012 .011 .050 .006 .009 -.014 O10 .363 -.085 .088 .020 .020 .015 .009 -.005 .003 O11 .253 -.107 -.156 .031 .007 .015 .014 -.011 -.008 O12 .215 -.028 .091 .031 .039 .021 .027 -.024 -.016 O13 .582 .027 .070 .022 .057 .006 .021 .011 .008 O14 .693 .111 -.160 .013 .013 .015 .006 .003 .014 O15 .781 .081 .070 .026 .027 .012 .005 .000 .018 O16 .754 -.032 -.178 .015 .054 .048 .026 .009 .034 O17 .633 -.126 .067 .013 .040 .007 .000 .003 .003 O18 .553 -.091 -.172 .003 .027 .045 -.004 -.009 -.009 O19 .064 .112 .366 .029 .010 .031 .009 .002 .006 O20 .115 .042 .611 .018 .018 .019 .005 .007 .007 O21 .550 .269 .535 .005 .007 .004 .001 .000 .004 O22 .623 .220 .302 .025 .030 .013 .024 -.009 -.012 O23 .263 .550 .615 .022 .006 .007 .008 .005 .001 O24 .395 .778 .377 .017 .014 .022 -.004 -.002 .006 O25 .260 .039 .344 .031 .033 .018 .030 -.011 -.002 O26 .378 .113 .578 .012 .016 .006 .010 .001 -.002 O27 .447 .060 .347 .005 .029 .017 .009 .006 -.003 O28 .400 -.050 .585 .007 .020 .009 .006 -.005 .005 O29 .281 -.123 .346 .020 .006 .017 .011 .000 -.003 O30 .211 -.074 .581 .012 .009 .017 .002 .005 .007 O31 .618 .074 .567 .003 .016 .007 -.005 -.004 .005 O32 .732 .116 .326 .018 .029 .018 .013 -.005 -.004 O33 .779 .055 .562 .031 .014 .004 .009 -.005 .003 O34 .707 -.067 .330 .022 .036 .034 .023 -.013 -.009 O35 .607 -.108 .567 .004 .019 .007 .004 .004 -.002 O36 .551 -.040 .337 .010 .016 .024 .004 -.006 .007