Positions and magnetic moments of all atoms in unit cell, with magnetic moment relations explicitly given:
Magnetic atoms:
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_1:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.62780 | 0.34220 | 0.58860 | mx,my,mz | 0.00000 | 2.09000 | -3.05000 |
2 | 0.87220 | 0.65780 | 0.41140 | mx,my,mz | 0.00000 | 2.09000 | -3.05000 |
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3 | 0.12780 | 0.34220 | 0.58860 | -mx,-my,-mz | 0.00000 | -2.09000 | 3.05000 |
4 | 0.37220 | 0.65780 | 0.41140 | -mx,-my,-mz | 0.00000 | -2.09000 | 3.05000 |
Set of atoms in the unit cell related by symmetry with the magnetic atom Fe1_2:
Atom | x | y | z | Symmetry constraints on M | Mx | My | Mz |
1 | 0.12220 | 0.84220 | 0.91140 | mx,my,mz | 0.00000 | 2.09000 | -3.05000 |
2 | 0.37780 | 0.15780 | 0.08860 | mx,my,mz | 0.00000 | 2.09000 | -3.05000 |
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3 | 0.62220 | 0.84220 | 0.91140 | -mx,-my,-mz | 0.00000 | -2.09000 | 3.05000 |
4 | 0.87780 | 0.15780 | 0.08860 | -mx,-my,-mz | 0.00000 | -2.09000 | 3.05000 |
Non-magnetic atoms:
Set of atoms in the unit cell related by symmetry with the atom P1_1:
Atom | x | y | z |
1 | 0.62950 | 0.66700 | 0.54600 |
2 | 0.87050 | 0.33300 | 0.45400 |
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3 | 0.12950 | 0.66700 | 0.54600 |
4 | 0.37050 | 0.33300 | 0.45400 |
Set of atoms in the unit cell related by symmetry with the atom P1_2:
Atom | x | y | z |
1 | 0.12050 | 0.16700 | 0.95400 |
2 | 0.37950 | 0.83300 | 0.04600 |
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3 | 0.62050 | 0.16700 | 0.95400 |
4 | 0.87950 | 0.83300 | 0.04600 |
Set of atoms in the unit cell related by symmetry with the atom O1_1:
Atom | x | y | z |
1 | 0.78060 | 0.84820 | 0.91660 |
2 | 0.71940 | 0.15180 | 0.08340 |
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3 | 0.28060 | 0.84820 | 0.91660 |
4 | 0.21940 | 0.15180 | 0.08340 |
Set of atoms in the unit cell related by symmetry with the atom O1_2:
Atom | x | y | z |
1 | 0.96940 | 0.34820 | 0.58340 |
2 | 0.53060 | 0.65180 | 0.41660 |
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3 | 0.46940 | 0.34820 | 0.58340 |
4 | 0.03060 | 0.65180 | 0.41660 |
Set of atoms in the unit cell related by symmetry with the atom O2_1:
Atom | x | y | z |
1 | 0.71650 | 0.67900 | 0.42000 |
2 | 0.78350 | 0.32100 | 0.58000 |
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3 | 0.21650 | 0.67900 | 0.42000 |
4 | 0.28350 | 0.32100 | 0.58000 |
Set of atoms in the unit cell related by symmetry with the atom O2_2:
Atom | x | y | z |
1 | 0.03350 | 0.17900 | 0.08000 |
2 | 0.46650 | 0.82100 | 0.92000 |
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3 | 0.53350 | 0.17900 | 0.08000 |
4 | 0.96650 | 0.82100 | 0.92000 |
Set of atoms in the unit cell related by symmetry with the atom O3_1:
Atom | x | y | z |
1 | 0.61350 | 0.78010 | 0.65880 |
2 | 0.88650 | 0.21990 | 0.34120 |
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3 | 0.11350 | 0.78010 | 0.65880 |
4 | 0.38650 | 0.21990 | 0.34120 |
Set of atoms in the unit cell related by symmetry with the atom O3_2:
Atom | x | y | z |
1 | 0.13650 | 0.28010 | 0.84120 |
2 | 0.36350 | 0.71990 | 0.15880 |
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3 | 0.63650 | 0.28010 | 0.84120 |
4 | 0.86350 | 0.71990 | 0.15880 |
Set of atoms in the unit cell related by symmetry with the atom O4_1:
Atom | x | y | z |
1 | 0.63250 | 0.53310 | 0.65880 |
2 | 0.86750 | 0.46690 | 0.34120 |
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3 | 0.13250 | 0.53310 | 0.65880 |
4 | 0.36750 | 0.46690 | 0.34120 |
Set of atoms in the unit cell related by symmetry with the atom O4_2:
Atom | x | y | z |
1 | 0.11750 | 0.03310 | 0.84120 |
2 | 0.38250 | 0.96690 | 0.15880 |
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3 | 0.61750 | 0.03310 | 0.84120 |
4 | 0.88250 | 0.96690 | 0.15880 |
Set of atoms in the unit cell related by symmetry with the atom N1_1:
Atom | x | y | z |
1 | 0.61465 | 0.14100 | 0.48680 |
2 | 0.88535 | 0.85900 | 0.51320 |
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3 | 0.11465 | 0.14100 | 0.48680 |
4 | 0.38535 | 0.85900 | 0.51320 |
Set of atoms in the unit cell related by symmetry with the atom N1_2:
Atom | x | y | z |
1 | 0.13535 | 0.64100 | 0.01320 |
2 | 0.36465 | 0.35900 | 0.98680 |
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3 | 0.63535 | 0.64100 | 0.01320 |
4 | 0.86465 | 0.35900 | 0.98680 |
Set of atoms in the unit cell related by symmetry with the atom D1_1:
Atom | x | y | z |
1 | 0.92100 | 0.37500 | 0.89970 |
2 | 0.57900 | 0.62500 | 0.10030 |
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3 | 0.42100 | 0.37500 | 0.89970 |
4 | 0.07900 | 0.62500 | 0.10030 |
Set of atoms in the unit cell related by symmetry with the atom D1_2:
Atom | x | y | z |
1 | 0.82900 | 0.87500 | 0.60030 |
2 | 0.67100 | 0.12500 | 0.39970 |
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3 | 0.32900 | 0.87500 | 0.60030 |
4 | 0.17100 | 0.12500 | 0.39970 |
Set of atoms in the unit cell related by symmetry with the atom D2_1:
Atom | x | y | z |
1 | 0.54900 | 0.13110 | 0.41680 |
2 | 0.95100 | 0.86890 | 0.58320 |
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3 | 0.04900 | 0.13110 | 0.41680 |
4 | 0.45100 | 0.86890 | 0.58320 |
Set of atoms in the unit cell related by symmetry with the atom D2_2:
Atom | x | y | z |
1 | 0.20100 | 0.63110 | 0.08320 |
2 | 0.29900 | 0.36890 | 0.91680 |
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3 | 0.70100 | 0.63110 | 0.08320 |
4 | 0.79900 | 0.36890 | 0.91680 |
Set of atoms in the unit cell related by symmetry with the atom D3_1:
Atom | x | y | z |
1 | 0.61800 | 0.07180 | 0.59300 |
2 | 0.88200 | 0.92820 | 0.40700 |
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3 | 0.11800 | 0.07180 | 0.59300 |
4 | 0.38200 | 0.92820 | 0.40700 |
Set of atoms in the unit cell related by symmetry with the atom D3_2:
Atom | x | y | z |
1 | 0.13200 | 0.57180 | 0.90700 |
2 | 0.36800 | 0.42820 | 0.09300 |
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3 | 0.63200 | 0.57180 | 0.90700 |
4 | 0.86800 | 0.42820 | 0.09300 |
Set of atoms in the unit cell related by symmetry with the atom N2_1:
Atom | x | y | z |
1 | 0.61750 | 0.39390 | 0.31770 |
2 | 0.88250 | 0.60610 | 0.68230 |
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3 | 0.11750 | 0.39390 | 0.31770 |
4 | 0.38250 | 0.60610 | 0.68230 |
Set of atoms in the unit cell related by symmetry with the atom N2_2:
Atom | x | y | z |
1 | 0.13250 | 0.89390 | 0.18230 |
2 | 0.36750 | 0.10610 | 0.81770 |
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3 | 0.63250 | 0.89390 | 0.18230 |
4 | 0.86750 | 0.10610 | 0.81770 |
Set of atoms in the unit cell related by symmetry with the atom D4_1:
Atom | x | y | z |
1 | 0.68100 | 0.97610 | 0.20100 |
2 | 0.81900 | 0.02390 | 0.79900 |
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3 | 0.18100 | 0.97610 | 0.20100 |
4 | 0.31900 | 0.02390 | 0.79900 |
Set of atoms in the unit cell related by symmetry with the atom D4_2:
Atom | x | y | z |
1 | 0.06900 | 0.47610 | 0.29900 |
2 | 0.43100 | 0.52390 | 0.70100 |
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3 | 0.56900 | 0.47610 | 0.29900 |
4 | 0.93100 | 0.52390 | 0.70100 |
Set of atoms in the unit cell related by symmetry with the atom D5_1:
Atom | x | y | z |
1 | 0.80850 | 0.56620 | 0.72060 |
2 | 0.69150 | 0.43380 | 0.27940 |
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3 | 0.30850 | 0.56620 | 0.72060 |
4 | 0.19150 | 0.43380 | 0.27940 |
Set of atoms in the unit cell related by symmetry with the atom D5_2:
Atom | x | y | z |
1 | 0.94150 | 0.06620 | 0.77940 |
2 | 0.55850 | 0.93380 | 0.22060 |
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3 | 0.44150 | 0.06620 | 0.77940 |
4 | 0.05850 | 0.93380 | 0.22060 |
Set of atoms in the unit cell related by symmetry with the atom D6_1:
Atom | x | y | z |
1 | 0.65750 | 0.82060 | 0.27100 |
2 | 0.84250 | 0.17940 | 0.72900 |
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3 | 0.15750 | 0.82060 | 0.27100 |
4 | 0.34250 | 0.17940 | 0.72900 |
Set of atoms in the unit cell related by symmetry with the atom D6_2:
Atom | x | y | z |
1 | 0.09250 | 0.32060 | 0.22900 |
2 | 0.40750 | 0.67940 | 0.77100 |
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3 | 0.59250 | 0.32060 | 0.22900 |
4 | 0.90750 | 0.67940 | 0.77100 |
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