Babingtonite
Nagashima M, Mitani K, Akasaka M
Mineralogy and Petrology 108 (2014) 287-301
Structural variation of babingtonite depending on cation
distribution at the octahedral sites
Note: Sample 3
Locality: Kandivali quarry, India
_database_code_amcsd 0020454
7.4664 11.6276 6.6813 91.564 93.889 104.203 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)
Ca1  .78083 .941884 .14282     .01044 .01438 .00811 .00835 .00182  .00148 -.00064
Ca2  .23781 .520298 .30422     .00890 .00701 .00941 .00962 .00115  .00036 -.00258
Fe1  .59366 .643743 .06087 .76 .00700 .00669 .00701 .00729 .00162  .00087  .00010
Mn1  .59366 .643743 .06087 .11 .00700 .00669 .00701 .00729 .00162  .00087  .00010
Mg1  .59366 .643743 .06087 .13 .00700 .00669 .00701 .00729 .00162  .00087  .00010
Fe2  .04708 .235381 .18413 .96 .00596 .00563 .00551 .00659 .00124  .00011 -.00006
Al2  .04708 .235381 .18413 .04 .00596 .00563 .00551 .00659 .00124  .00011 -.00006
Si1  .28792  .05313 .34073     .00661 .00778 .00560 .00608 .00126 -.00035 -.00006
Si2  .46037  .31321 .42487     .00582 .00545 .00574 .00589 .00074  .00009  .00023
Si3  .80615  .44499 .20939     .00562 .00508 .00575 .00594 .00121  .00037  .00029
Si4  .98700  .71334 .31035     .00577 .00597 .00539 .00587 .00132  .00034  .00005
Si5  .32652  .83540 .10588     .00640 .00578 .00621 .00742 .00178  .00082  .00025
O1   .19808  .98701 .53389     .01193  .0163  .0094  .0079 -.0014   .0016   .0011
O2   .13002  .08054 .18390     .00863  .0092  .0097  .0077  .0039  -.0002   .0000
O3   .43355  .17094 .43658     .00986  .0108  .0059  .0116  .0005  -.0025   .0000
O4   .31674  .33806 .24585     .00768  .0070  .0080  .0077  .0016  -.0007   .0010
O5   .55014  .62043 .36545     .00930  .0093  .0103  .0077  .0014   .0014  -.0018
O6   .67761  .37047 .37311     .00814  .0063  .0095  .0081  .0005   .0011   .0018
O7   .96957  .38440 .15711     .00858  .0075  .0075  .0111  .0026   .0010  -.0006
O8   .67801  .47511 .02636     .00840  .0079  .0100  .0074  .0025  -.0007   .0014
O9   .92538  .56849 .33848     .00802  .0085  .0053  .0096  .0010  -.0008   .0000
O10  .87157  .75503 .12447     .00811  .0073  .0094  .0078  .0027  -.0002   .0015
O11  .02202  .22098 .47818     .00957  .0126  .0082  .0072  .0009   .0024  -.0012
O12  .20410  .73687 .25076     .00856  .0065  .0100  .0095  .0020   .0017   .0028
O13  .50949  .79815 .05524     .00999  .0081  .0098  .0131  .0038   .0026   .0008
O14  .80653  .14258 .08221     .00924  .0084  .0089  .0095  .0008  -.0017   .0017
O15  .39452  .96725 .22438     .01052  .0102  .0078  .0132  .0021   .0002  -.0030
H1     .119   .9061   .517       .050