Spheniscidite
Cavellec M, Riou D, Ferey G
Acta Crystallographica C50 (1994) 1379-1381
Synthetic spheniscidite
Locality: synthetic
_database_code_amcsd 0010294
9.8232 9.7376 9.8716 90 102.803 90 P2_1/n
atom      x      y      z  Uiso U(1,1) U(2,2) U(3,3)  U(1,2) U(1,3)  U(2,3)
Fe1  .60167 .23175 .31330 .0070  .0069  .0075  .0064  .00070 .00080 -.00020
Fe2  .88696 .95511 .87003 .0071  .0073  .0078  .0061 -.00030 .00110 -.00030
P1   .79641 .03494 .14807 .0070  .0071  .0071  .0072   .0006  .0022  -.0006
P2   .79230 .18304 .63129 .0070  .0074  .0064  .0064  -.0003 -.0002   .0003
O1    .7814  .0406  .6986 .0109  .0123  .0078  .0107  -.0010 -.0015   .0025
O2    .6877  .1309  .1833 .0122  .0124  .0138  .0110   .0046  .0036  -.0023
O3    .7135  .3934  .2846 .0110  .0132  .0078  .0133  -.0004  .0060  -.0013
O4    .7623  .0184 -.0121 .0101  .0096  .0135  .0068   .0021  .0013  -.0013
O5    .0549 -.0931  .8012 .0105  .0097  .0118  .0101  -.0019  .0025  -.0032
O6    .7375  .1688  .4751 .0121  .0142  .0127  .0074   .0022 -.0018   .0004
O7    .5007  .3587  .4403 .0087  .0088  .0088  .0084  -.0009  .0020  -.0003
O8    .4451  .2718  .1578 .0126  .0088  .0179  .0098   .0044 -.0006  -.0015
O9    .7952  .7840  .8045 .0124  .0171  .0100  .0104  -.0055  .0034  -.0011
O10   .4941  .0534  .3443 .0203  .0118  .0184  .0290  -.0034  .0016   .0071
O11   .6809  .8532  .4654 .0253  .0330  .0220  .0230  -.0034  .0098  -.0066
N     .5103  .1894  .8969 .0210  .0200  .0270  .0160   .0013  .0030   .0048
H1     .601   .146  -.094  .050
H2     .502   .269  -.168  .050
H3     .435   .125  -.141   .06
H4     .500   .224  -.011   .06
H5     .541  -.019   .386  .040
H6     .404   .033   .323   .05
H7     .738  -.102   .533  .040
H8     .719  -.154   .392   .07
H9     .435   .303   .461   .07