Fe16 S32
1.0
0.000000 5.430155 0.000000
0.000000 0.000000 5.430155
32.580930 -0.000000 0.000000
Fe S
16 32
Selective dynamics
direct
0.000000 0.500000 0.208333 T T T Fe4+
0.500000 0.000000 0.208333 T T T Fe4+
0.000000 0.000000 0.291667 T T T Fe4+
0.500000 0.500000 0.291667 T T T Fe4+
0.000000 0.500000 0.375000 F F F Fe4+
0.500000 0.000000 0.375000 F F F Fe4+
0.000000 0.000000 0.458333 F F F Fe4+
0.500000 0.500000 0.458333 F F F Fe4+
0.000000 0.500000 0.541667 F F F Fe4+
0.500000 0.000000 0.541667 F F F Fe4+
0.000000 0.000000 0.625000 F F F Fe4+
0.500000 0.500000 0.625000 F F F Fe4+
0.000000 0.500000 0.708333 T T T Fe4+
0.500000 0.000000 0.708333 T T T Fe4+
0.000000 0.000000 0.791667 T T T Fe4+
0.500000 0.500000 0.791667 T T T Fe4+
0.384938 0.384938 0.189156 T T T S2-
0.115062 0.884938 0.189156 T T T S2-
0.615062 0.615062 0.227510 T T T S2-
0.884938 0.115062 0.227510 T T T S2-
0.115062 0.615062 0.272490 T T T S2-
0.384938 0.115062 0.272490 T T T S2-
0.884938 0.384938 0.310844 T T T S2-
0.615062 0.884938 0.310844 T T T S2-
0.384938 0.384938 0.355823 F F F S2-
0.115062 0.884938 0.355823 F F F S2-
0.615062 0.615062 0.394177 F F F S2-
0.884938 0.115062 0.394177 F F F S2-
0.115062 0.615062 0.439156 F F F S2-
0.384938 0.115062 0.439156 F F F S2-
0.884938 0.384938 0.477510 F F F S2-
0.615062 0.884938 0.477510 F F F S2-
0.384938 0.384938 0.522490 F F F S2-
0.115062 0.884938 0.522490 F F F S2-
0.615062 0.615062 0.560844 F F F S2-
0.884938 0.115062 0.560844 F F F S2-
0.115062 0.615062 0.605823 F F F S2-
0.384938 0.115062 0.605823 F F F S2-
0.884938 0.384938 0.644177 F F F S2-
0.615062 0.884938 0.644177 F F F S2-
0.384938 0.384938 0.689156 T T T S2-
0.115062 0.884938 0.689156 T T T S2-
0.615062 0.615062 0.727510 T T T S2-
0.884938 0.115062 0.727510 T T T S2-
0.115062 0.615062 0.772490 T T T S2-
0.384938 0.115062 0.772490 T T T S2-
0.884938 0.384938 0.810844 T T T S2-
0.615062 0.884938 0.810844 T T T S2-
