From NWChem
group number = 195
group name = P23
crystal system = Cubic
setting number = 1
number of symmetry operators = 12
+x,+y,+z
-x,-y,+z
-x,+y,-z
+x,-y,-z
+z,+x,+y
+z,-x,-y
-z,-x,+y
-z,+x,-y
+y,+z,+x
-y,+z,-x
+y,-z,-x
-y,-z,+x
= operator 1 =
1.0 0.0 0.0 0.0
0.0 1.0 0.0 0.0
0.0 0.0 1.0 0.0
= operator 2 =
-1.0 0.0 0.0 0.0
0.0 -1.0 0.0 0.0
0.0 0.0 1.0 0.0
= operator 3 =
-1.0 0.0 0.0 0.0
0.0 1.0 0.0 0.0
0.0 0.0 -1.0 0.0
= operator 4 =
1.0 0.0 0.0 0.0
0.0 -1.0 0.0 0.0
0.0 0.0 -1.0 0.0
= operator 5 =
0.0 0.0 1.0 0.0
1.0 0.0 0.0 0.0
0.0 1.0 0.0 0.0
= operator 6 =
0.0 0.0 1.0 0.0
-1.0 0.0 0.0 0.0
0.0 -1.0 0.0 0.0
= operator 7 =
0.0 0.0 -1.0 0.0
-1.0 0.0 0.0 0.0
0.0 1.0 0.0 0.0
= operator 8 =
0.0 0.0 -1.0 0.0
1.0 0.0 0.0 0.0
0.0 -1.0 0.0 0.0
= operator 9 =
0.0 1.0 0.0 0.0
0.0 0.0 1.0 0.0
1.0 0.0 0.0 0.0
= operator 10 =
0.0 -1.0 0.0 0.0
0.0 0.0 1.0 0.0
-1.0 0.0 0.0 0.0
= operator 11 =
0.0 1.0 0.0 0.0
0.0 0.0 -1.0 0.0
-1.0 0.0 0.0 0.0
= operator 12 =
0.0 -1.0 0.0 0.0
0.0 0.0 -1.0 0.0
1.0 0.0 0.0 0.0
