Kupletskite Piilonen P C, McDonald A M, Lalonde A E The Canadian Mineralogist 41 (2003) 27-54 Insights into astrophyllite-group minerals II: Crystal chemistry Sample: MSH9 Locality: nepheline syenite pegmatite at Mont Saint-Hilaire, Quebec, Canada _database_code_amcsd 0005813 5.3989 11.9528 11.7458 112.983 94.854 103.062 P-1 atom x y z occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Mn(1) .8496 .20560 .47845 .860 .0090 .0076 .0091 .0114 .0027 .0025 .0051 Na(1) .8496 .20560 .47845 .140 .0090 .0076 .0091 .0114 .0027 .0025 .0051 Mn(2) .2797 .0666 .48678 .980 .0103 .0092 .0114 .0127 .0039 .0042 .0066 Mn(3) .4221 .35134 .48352 .973 .0106 .0093 .0115 .0139 .0041 .0041 .0071 Mn(4) 0 .5 .5 .474 .0092 .0071 .0090 .0105 .0017 .0014 .0037 Ti .0791 .08608 .19615 .929 .0081 .0049 .0098 .0101 .0020 .0016 .0048 Nb .0791 .08608 .19615 .071 .0081 .0049 .0098 .0101 .0020 .0016 .0048 Si(1) .6784 .2716 .2299 .0083 .0079 .0076 .0097 .0025 .0019 .0038 Si(2) .8118 .5464 .2528 .0101 .0105 .0098 .0107 .0030 .0018 .0048 Si(3) .3771 .6752 .2555 .0097 .0095 .0097 .0117 .0029 .0022 .0063 Si(4) .5077 .9312 .2343 .0082 .0085 .0082 .0091 .0021 .0021 .0048 K .1311 .2630 .9953 .90 .0493 .0508 .0623 .0265 .0151 .0048 .0113 Na .1311 .2630 .9953 .10 .0493 .0508 .0623 .0265 .0151 .0048 .0113 Na .5 0 0 .205 .0120 .0153 .0121 .0077 .0034 .0013 .0038 Ca .5 0 0 .295 .0120 .0153 .0121 .0077 .0034 .0013 .0038 O(1) .7279 .3175 .3817 .0108 .0106 .0130 .0094 .0039 .0027 .0048 O(2) .1461 .1585 .3667 .0117 .0137 .0126 .0092 .0042 .0038 .0043 O(3) .1282 .3922 .5945 .0107 .0089 .0139 .0094 .0031 .0015 .0050 OH(4) .2976 .4626 .3967 .0136 .0118 .0137 .0149 .0023 .0016 .0064 OH(5) .9913 .1190 .5947 .0129 .0113 .0138 .0141 .0035 .0034 .0063 O(6) .5585 .2579 .5917 .0098 .0087 .0092 .0113 .0020 .0003 .0046 O(7) .5757 .0136 .3865 .0114 .0112 .0134 .0094 .0059 .0030 .0031 O(8) .0694 .5924 .2004 .0184 .0162 .0199 .0168 -.0009 .0051 .0081 O(9) .2456 .0410 .8291 .0202 .0146 .0238 .0146 -.0044 .0067 .0049 O(10) .4342 .4164 .7995 .0174 .0203 .0217 .0143 .0126 .0032 .0082 O(11) .1290 .8094 .8337 .0198 .0258 .0274 .0145 .0199 .0081 .0098 O(12) .2621 .9567 .1704 .0193 .0240 .0210 .0116 .0142 -.0029 .0027 O(13) .2650 .6068 .8062 .0182 .0268 .0128 .0142 .0041 .0044 .0055 O(14) .5699 .2210 .8025 .0177 .0248 .0132 .0170 .0037 .0041 .0091 O(15) .3812 .1908 .1669 .0203 .0107 .0295 .0173 -.0062 -.0010 .0138 F(16) 0 0 0 .50 .0141 .0152 .0138 .0128 .0051 .0011 .0051