MAGNDATA - Collection of Magnetic Structures

Symmetry operations of the magnetic space group in the setting used:

N	(x,y,z)	Seitz notation
1	x,y,z,+1	{ 1 \| 0 }
2	-x,-x+y,-z+1/2,+1	{ 2₀₁₀ \| 0 0 1/2 }
3	-x,-y,-z,+1	{ -1 \| 0 }
4	x,x-y,z+1/2,+1	{ m₀₁₀ \| 0 0 1/2 }
(1/3,2/3,1/3) + set click here to show and hide
5	x+1/3,y+2/3,z+1/3,+1	{ 1 \| 1/3 2/3 1/3 }
6	-x+1/3,-x+y+2/3,-z+5/6,+1	{ 2₀₁₀ \| 1/3 2/3 5/6 }
7	-x+1/3,-y+2/3,-z+1/3,+1	{ -1 \| 1/3 2/3 1/3 }
8	x+1/3,x-y+2/3,z+5/6,+1	{ m₀₁₀ \| 1/3 2/3 5/6 }
(2/3,1/3,2/3) + set click here to show and hide
9	x+2/3,y+1/3,z+2/3,+1	{ 1 \| 2/3 1/3 2/3 }
10	-x+2/3,-x+y+1/3,-z+1/6,+1	{ 2₀₁₀ \| 2/3 1/3 1/6 }
11	-x+2/3,-y+1/3,-z+2/3,+1	{ -1 \| 2/3 1/3 2/3 }
12	x+2/3,x-y+1/3,z+1/6,+1	{ m₀₁₀ \| 2/3 1/3 1/6 }
(0,0,1/2)' + set click here to show and hide
13	x,y,z+1/2,-1	{ 1' \| 0 0 1/2 }
14	-x,-x+y,-z,-1	{ 2'₀₁₀ \| 0 }
15	-x,-y,-z+1/2,-1	{ -1' \| 0 0 1/2 }
16	x,x-y,z,-1	{ m'₀₁₀ \| 0 }
(1/3,2/3,5/6)' + set click here to show and hide
17	x+1/3,y+2/3,z+5/6,-1	{ 1' \| 1/3 2/3 5/6 }
18	-x+1/3,-x+y+2/3,-z+1/3,-1	{ 2'₀₁₀ \| 1/3 2/3 1/3 }
19	-x+1/3,-y+2/3,-z+5/6,-1	{ -1' \| 1/3 2/3 5/6 }
20	x+1/3,x-y+2/3,z+1/3,-1	{ m'₀₁₀ \| 1/3 2/3 1/3 }
(2/3,1/3,1/6)' + set click here to show and hide
21	x+2/3,y+1/3,z+1/6,-1	{ 1' \| 2/3 1/3 1/6 }
22	-x+2/3,-x+y+1/3,-z+2/3,-1	{ 2'₀₁₀ \| 2/3 1/3 2/3 }
23	-x+2/3,-y+1/3,-z+1/6,-1	{ -1' \| 2/3 1/3 1/6 }
24	x+2/3,x-y+1/3,z+2/3,-1	{ m'₀₁₀ \| 2/3 1/3 2/3 }

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Symmetry operations of the magnetic point group in the setting used:

N	(x,y,z)	Seitz notation
1	x,y,z,+1	1
2	-x,-x+y,-z,+1	2₀₁₀
3	-x,-y,-z,+1	-1
4	x,x-y,z,+1	m₀₁₀
1' + set click here to show and hide
5	x,y,z,-1	1'
6	-x,-x+y,-z,-1	2'₀₁₀
7	-x,-y,-z,-1	-1'
8	x,x-y,z,-1	m'₀₁₀

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Magnetic atoms:

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ni1	Ni	0.00000	0.00000	0.00000	6	2m_y,m_y,m_z	2.31	1.155	0.0	2.00

Non-magnetic atoms:

Label	Atom type	x	y	z	Multiplicity
Br1	Br	0.00000	0.00000	0.12750	12

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	2m_y,m_y,m_z	2.31000	1.15500	0.00000
(1/3,2/3,1/3) + set click here to show and hide
2	0.33333	0.66667	0.33333	2m_y,m_y,m_z	2.31000	1.15500	0.00000
(2/3,1/3,2/3) + set click here to show and hide
3	0.66667	0.33333	0.66667	2m_y,m_y,m_z	2.31000	1.15500	0.00000
(0,0,1/2)' + set click here to show and hide
4	0.00000	0.00000	0.50000	-2m_y,-m_y,-m_z	-2.31000	-1.15500	0.00000
(1/3,2/3,5/6)' + set click here to show and hide
5	0.33333	0.66667	0.83333	-2m_y,-m_y,-m_z	-2.31000	-1.15500	0.00000
(2/3,1/3,1/6)' + set click here to show and hide
6	0.66667	0.33333	0.16667	-2m_y,-m_y,-m_z	-2.31000	-1.15500	0.00000

Atom	x	y	z
1	0.00000	0.00000	0.12750
2	0.00000	0.00000	0.37250
(1/3,2/3,1/3) + set click here to show and hide
3	0.33333	0.66667	0.46083
4	0.33333	0.66667	0.70583
(2/3,1/3,2/3) + set click here to show and hide
5	0.66667	0.33333	0.79417
6	0.66667	0.33333	0.03917
(0,0,1/2)' + set click here to show and hide
7	0.00000	0.00000	0.62750
8	0.00000	0.00000	0.87250
(1/3,2/3,5/6)' + set click here to show and hide
9	0.33333	0.66667	0.96083
10	0.33333	0.66667	0.20583
(2/3,1/3,1/6)' + set click here to show and hide
11	0.66667	0.33333	0.29417
12	0.66667	0.33333	0.53917

Label	Atom type	x	y	z	Multiplicity	Symmetry constraints on M	M_x	M_y	M_z	\|M\|
Ni1	Ni	0.00000	0.00000	0.00000	6	2m_y,m_y,m_z	2.31	1.155	0.0	2.00

Atom	x	y	z	Symmetry constraints on M	M_x	M_y	M_z
1	0.00000	0.00000	0.00000	2m_y,m_y,m_z	2.31000	1.15500	0.00000
(1/3,2/3,1/3) + set click here to show and hide
2	0.33333	0.66667	0.33333	2m_y,m_y,m_z	2.31000	1.15500	0.00000
(2/3,1/3,2/3) + set click here to show and hide
3	0.66667	0.33333	0.66667	2m_y,m_y,m_z	2.31000	1.15500	0.00000
(0,0,1/2)' + set click here to show and hide
4	0.00000	0.00000	0.50000	-2m_y,-m_y,-m_z	-2.31000	-1.15500	0.00000
(1/3,2/3,5/6)' + set click here to show and hide
5	0.33333	0.66667	0.83333	-2m_y,-m_y,-m_z	-2.31000	-1.15500	0.00000
(2/3,1/3,1/6)' + set click here to show and hide
6	0.66667	0.33333	0.16667	-2m_y,-m_y,-m_z	-2.31000	-1.15500	0.00000

MAGNDATA: A Collection of magnetic structures with portable cif-type files