Calclacite
Giuseppetti G, Tadini C, Ungaretti L
Periodico di Mineralogia 39 (1970) 145-158
La struttura cristallina della calclacite
Locality: synthetic
_database_code_amcsd 0019021
6.82 13.72 11.51 90 116.7 90 P2_1/c
atom        x      y      z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Ca      .1790  .0281  .4078 1.65  .0107  .0022  .0046  .0001  .0040  .0003
C(1)    .6191  .0542  .3282 2.09  .0106  .0030  .0061  .0003  .0042  .0006
C(2)    .5244  .1029  .1987 4.16  .0251  .0076  .0073  .0026  .0063  .0040
O(1)    .4953  .0266  .3781 3.18  .0163  .0056  .0078 -.0003  .0065  .0015
O(2)    .1769 -.0398  .6114 2.84  .0218  .0034  .0065  .0004  .0055  .0009
Cl      .1424 -.1659  .0305 3.74  .0273  .0042  .0087  .0011  .0058 -.0010
WatO(3) .0338  .0162 -.1694 3.53  .0244  .0049  .0083  .0011  .0072 -.0006
WatO(4) .0967  .1791  .2883 4.53  .0370  .0040  .0089 -.0010  .0036  .0023
WatO(5) .2763  .1695  .5571 4.04  .0351  .0036  .0094 -.0015  .0075 -.0009
WatO(6) .2256 -.1478  .3849 4.16  .0377  .0028  .0121 -.0006  .0108 -.0009
WatO(7) .3421  .1536  .8156 4.23  .0301  .0041  .0109  .0006  .0063 -.0008