Bannisterite Heaney P J, Post J E, Evans H T Clays and Clay Minerals 40 (1992) 129-144 The crystal structure of bannisterite Locality: Franklin Furnace, New Jersey, USA _database_code_amcsd 0012234 22.265 16.368 24.668 90 94.285 90 A2/a atom x y z occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) Mn1 .06395 .39172 .25824 .622 .0082 .0083 .0126 -.0009 .0000 -.0010 Fe1 .06395 .39172 .25824 .145 .0082 .0083 .0126 -.0009 .0000 -.0010 Mg1 .06395 .39172 .25824 .143 .0082 .0083 .0126 -.0009 .0000 -.0010 Zn1 .06395 .39172 .25824 .101 .0082 .0083 .0126 -.0009 .0000 -.0010 Mn2 .06248 .19552 .24150 .622 .0063 .0084 .0117 -.0008 .0001 -.0002 Fe2 .06248 .19552 .24150 .145 .0063 .0084 .0117 -.0008 .0001 -.0002 Mg2 .06248 .19552 .24150 .143 .0063 .0084 .0117 -.0008 .0001 -.0002 Zn2 .06248 .19552 .24150 .101 .0063 .0084 .0117 -.0008 .0001 -.0002 Mn3 .18958 .48451 .25857 .622 .0070 .0093 .0143 .0005 .0000 .0018 Fe3 .18958 .48451 .25857 .145 .0070 .0093 .0143 .0005 .0000 .0018 Mg3 .18958 .48451 .25857 .143 .0070 .0093 .0143 .0005 .0000 .0018 Zn3 .18958 .48451 .25857 .101 .0070 .0093 .0143 .0005 .0000 .0018 Mn4 .18614 .28580 .23989 .622 .0067 .0076 .0126 -.0005 -.0008 -.0009 Fe4 .18614 .28580 .23989 .145 .0067 .0076 .0126 -.0005 -.0008 -.0009 Mg4 .18614 .28580 .23989 .143 .0067 .0076 .0126 -.0005 -.0008 -.0009 Zn4 .18614 .28580 .23989 .101 .0067 .0076 .0126 -.0005 -.0008 -.0009 Mn5 .18593 .08659 .23173 .622 .0098 .0091 .0160 -.0003 -.0011 -.0013 Fe5 .18593 .08659 .23173 .145 .0098 .0091 .0160 -.0003 -.0011 -.0013 Mg5 .18593 .08659 .23173 .143 .0098 .0091 .0160 -.0003 -.0011 -.0013 Zn5 .18593 .08659 .23173 .101 .0098 .0091 .0160 -.0003 -.0011 -.0013 Mn6 .31203 .38372 .24574 .622 .0079 .0096 .0180 .0010 .0002 .0023 Fe6 .31203 .38372 .24574 .145 .0079 .0096 .0180 .0010 .0002 .0023 Mg6 .31203 .38372 .24574 .143 .0079 .0096 .0180 .0010 .0002 .0023 Zn6 .31203 .38372 .24574 .101 .0079 .0096 .0180 .0010 .0002 .0023 Mn7 .31049 .18732 .23522 .622 .0075 .0088 .0163 .0004 .0066 .0009 Fe7 .31049 .18732 .23522 .145 .0075 .0088 .0163 .0004 .0066 .0009 Mg7 .31049 .18732 .23522 .143 .0075 .0088 .0163 .0004 .0066 .0009 Zn7 .31049 .18732 .23522 .101 .0075 .0088 .0163 .0004 .0066 .0009 Mn8 .43868 .49424 .26580 .622 .0085 .0107 .0161 .0024 .0003 .0035 Fe8 .43868 .49424 .26580 .145 .0085 .0107 .0161 .0024 .0003 .0035 Mg8 .43868 .49424 .26580 .143 .0085 .0107 .0161 .0024 .0003 .0035 Zn8 .43868 .49424 .26580 .101 .0085 .0107 .0161 .0024 .0003 .0035 Mn9 .43620 .29186 .24771 .622 .0074 .0104 .0148 .0013 .0000 .0041 Fe9 .43620 .29186 .24771 .145 .0074 .0104 .0148 .0013 .0000 .0041 Mg9 .43620 .29186 .24771 .143 .0074 .0104 .0148 .0013 .0000 .0041 Zn9 .43620 .29186 .24771 .101 .0074 .0104 .0148 .0013 .0000 .0041 Mn10 .43463 .09284 .23280 .622 .0092 .0106 .0153 .0014 .0000 .0021 Fe10 .43463 .09284 .23280 .145 .0092 .0106 .0153 .0014 .0000 .0021 Mg10 .43463 .09284 .23280 .143 .0092 .0106 .0153 .0014 .0000 .0021 Zn10 .43463 .09284 .23280 .101 .0092 .0106 .0153 .0014 .0000 .0021 Si1 .12270 .40077 .14081 .0110 .0090 .0104 -.0018 .0004 -.0012 Si2 .39940 .40175 .14188 .0108 .0092 .0107 .0012 -.0021 -.0001 Si3 .52182 .31674 .14681 .0106 .0084 .0102 -.0001 -.0011 -.0009 Si4 .52240 .13016 .12889 .0101 .0095 .0128 .0005 -.0019 .0000 Si5 .64491 .04461 .12863 .0095 .0096 .0125 -.0008 -.0016 -.0011 Si6 .63959 .41334 .15176 .0090 .0089 .0120 .0001 -.0011 .0012 Si7 .76218 .32817 .15285 .0095 .0085 .0118 .0007 -.0001 .0002 Si8 .76175 .14303 .14316 .0078 .0077 .0133 -.0002 -.0014 .0005 Si9 .87565 .04426 .12768 .0085 .0104 .0124 .0013 -.0005 -.0016 Si10 .88471 .41233 .15251 .0083 .0082 .0108 -.0009 -.0006 .0004 Si11 .00114 .31556 .14498 .0086 .0081 .0108 -.0008 -.0003 -.0011 Si12 .99855 .12907 .12746 .0111 .0091 .0121 -.0006 .0001 -.0004 Si13 .11195 .10663 .06457 .812 .0141 .0106 .0113 .0000 .0015 .0000 Al13 .11195 .10663 .06457 .188 .0141 .0106 .0113 .0000 .0015 .0000 Si14 .18290 .27325 .06420 .645 .0137 .0126 .0108 .0004 -.0006 -.0009 Al14 .18290 .27325 .06420 .355 .0137 .0126 .0108 .0004 -.0006 -.0009 Si15 .32666 .27436 .06447 .446 .0120 .0140 .0136 .0003 -.0012 -.0014 Al15 .32666 .27436 .06447 .554 .0120 .0140 .0136 .0003 -.0012 -.0014 Si16 .39832 .10806 .06528 .921 .0106 .0102 .0109 .0005 -.0011 .0001 Al16 .39832 .10806 .06528 .079 .0106 .0102 .0109 .0005 -.0011 .0001 O1 .1376 .3892 .2052 .0114 .0112 .0163 -.0019 -.0023 .0017 O2 .3955 .3924 .2069 .0112 .0117 .0141 -.0018 .0015 -.0014 O3 .4797 .1919 .2884 .0109 .0100 .0184 .0019 .0020 -.0001 O4 .4824 .3917 .3077 .0116 .0169 .0163 -.0002 -.0006 .0063 O5 .3570 .4795 .3083 .0112 .0159 .0208 -.0014 .0001 .0006 O6 .3564 .0855 .2829 .0119 .0111 .0113 -.0010 -.0009 -.0021 O7 .2323 .1795 .2823 .0142 .0094 .0102 .0000 .0022 -.0004 O8 .2324 .3728 .2925 .0121 .0109 .0122 -.0030 -.0017 -.0010 O9 .1129 .4785 .3089 .0138 .0115 .0177 -.0022 .0016 -.0010 O10 .1081 .0883 .2825 .0105 .0108 .0138 -.0020 -.0009 .0005 O11 .0129 .3051 .2098 .0119 .0126 .0128 -.0031 .0022 .0020 O12 .0125 .1081 .1913 .0134 .0140 .0161 -.0065 -.0004 .0020 O13 .1029 .0964 -.0007 .0328 .0238 .0146 -.0061 -.0016 .0005 O14 .1662 .3003 .0009 .0196 .0194 .0215 .0039 -.0017 .0010 O15 .1300 .4961 .1258 .0235 .0111 .0135 -.0052 -.0019 .0015 O16 .0536 .3725 .1235 .0147 .0151 .0130 -.0051 -.0036 .0042 O17 .1678 .3514 .1054 .0193 .0193 .0145 .0011 -.0008 .0009 O18 .1406 .1956 .0820 .0171 .0236 .0132 -.0008 -.0010 -.0024 O19 .0469 .0914 .0899 .0207 .0101 .0203 -.0032 .0022 -.0026 O20 .1557 .0336 .0909 .0200 .0168 .0274 -.0027 .0059 .0045 O21 .2553 .2530 .0762 .0166 .0237 .0189 -.0016 .0008 -.0050 O22 .3923 .4979 .1276 .0177 .0130 .0142 .0027 -.0027 -.0002 O23 .4644 .3715 .1242 .0151 .0166 .0114 .0072 -.0003 .0023 O24 .3472 .3541 .1064 .0150 .0158 .0199 -.0035 -.0053 .0000 O25 .3720 .1943 .0827 .0173 .0189 .0174 .0018 -.0058 -.0010 O26 .3594 .0352 .0905 .0101 .0205 .0271 .0004 -.0059 .0028 O27 .4673 .0933 .0911 .0082 .0120 .0295 -.0005 -.0076 -.0029 O28 .4791 .2721 .3808 .0204 .0125 .0139 -.0001 -.0033 .0001 O29 .2992 .1252 .3695 .0101 .0145 .0152 .0031 -.0022 -.0006 O30 .4181 .1402 .3714 .0157 .0181 .0144 -.0044 -.0044 .0021 O31 .4164 .4063 .3917 .0118 .0173 .0101 .0030 .0006 .0010 O32 .3010 .3947 .3828 .0136 .0214 .0166 -.0039 -.0045 .0073 O33 .2389 .2621 .3739 .0213 .0105 .0132 -.0016 -.0037 -.0023 O34 .1811 .1234 .3684 .0151 .0135 .0115 -.0019 -.0036 .0027 O35 .0632 .1434 .3713 .0136 .0172 .0151 .0047 -.0028 -.0038 O36 .0006 .2728 .3831 .0245 .0103 .0138 -.0002 -.0025 .0004 O37 .0674 .4063 .3925 .0173 .0153 .0175 -.0016 -.0017 .0050 O38 .1818 .3971 .3845 .0167 .0193 .0150 .0060 .0007 .0004 OH39 .0203 .4961 .2229 .0193 .0107 .0136 -.0014 .0001 -.0001 OH40 .3926 .1967 .1983 .0184 .0114 .0186 .0041 .0020 -.0006 OH41 .2704 .4897 .2159 .0158 .0097 .0151 .0024 .0018 -.0004 OH42 .2656 .2898 .2005 .0139 .0161 .0160 .0028 -.0005 .0060 OH43 .2684 .0841 .1937 .0162 .0152 .0113 .0013 -.0005 .0009 OH44 .1393 .1924 .1975 .0151 .0135 .0129 -.0033 -.0015 -.0003 OH45 .3552 .2839 .2874 .0148 .0131 .0143 .0004 -.0014 -.0007 OH46 .1092 .2856 .2895 .0156 .0124 .0139 -.0019 -.0012 -.0019 Ca .2309 .5613 .0010 .5 .075 .044 .110 -.011 .000 .000 K1 .2653 .9560 -.0030 .188 .119 .106 .0080 .008 -.055 -.011 K2 .0182 .9721 .0012 .192 .056 .097 .022 -.062 -.008 .005 Wat50 .2550 .4707 .0753 .041 .040 .087 -.005 -.004 -.018 Wat51 .1496 .4745 .0003 .5 .049 .039 .040 .010 -.003 .001 Wat52 .1360 .6495 -.0009 .5 .134 .0142 .129 .047 -.012 .006 Wat53 .2594 .6961 -.0036 .5 .581 .118 .072 -.216 .064 -.044 Wat54 .3393 .5582 .0012 .5 .094 .503 .077 .004 -.008 -.023 Wat55 .1716 .8285 -.0003 .5 .345 .195 .028 -.089 -.018 -.001 Wat56 .4098 .4543 .0021 .5 .740 .245 .091 .029 .123 .028 Wat57 .25 .1054 0 .43 .067 .110 .100 0 -.031 0 Wat58 .5000 .2932 -.0007 .46 .740 .611 .007 .338 -.010 -.005 Wat59 .4670 .5607 .0092 .67 .262 .695 .383 -.330 .151 -.214 Wat60 .3837 .7969 -.0003 .5 .299 .556 .184 -.142 -.042 .003