Chondrodite
Kunz M, Lager G A, Burgi H B, Fernandez-Diaz M T
Physics and Chemistry of Minerals 33 (2006) 17-27
High-temperature single-crystal neutron diffraction
study of natural chondrodite
Locality: Tilly Foster Mine, Brewster, New York
Sample: T = 500 K
_database_code_amcsd 0009017
4.7375 10.2920 7.8897 109.071 90 90 P2_1/b
atom      x      y      z occ   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Mg1      .5      0     .5 .88  .0081  .0064  .0086  .0078  .0010  .0013  .0006
Fe1      .5      0     .5 .12  .0081  .0064  .0086  .0078  .0010  .0013  .0006
Mg2   .0104 .17338 .30720     .00747  .0074  .0069  .0085  .0003 -.0001  .0031
Mg3   .4917 .88608 .07902     .00810  .0083  .0085  .0078 -.0001 -.0007  .0031
Si    .0764 .14428 .70407      .0053  .0037  .0062  .0060 -.0001 -.0001  .0019
O1    .7794 .00060 .29406     .00778  .0074  .0064  .0101  .0002  .0003  .0035
O2    .7267 .24097 .12552     .00803  .0072  .0075  .0075 -.0002  .0006 -.0002
O3    .2235 .16901 .52906     .00783  .0070  .0103  .0072 -.0003  .0001  .0043
O4   .26390 .85468 .29459     .00763  .0043  .0094  .0091 -.0001  .0001  .0028
Oh5    .247  .0532  .0922 .43  .0100  .0097  .0094  .0104  .0005  .0017  .0027
H     .0899  .0139  .0197 .43  .0272   .018   .030   .028 -.0038 -.0057  .0025
F     .2686  .0592  .1038 .57  .0100  .0097  .0094  .0104  .0005  .0017  .0027