# Poscar file from str.out
1.0
	-3.4097    0.0        -11.4104
	1.70485    2.952887   -11.4104
	1.70485    -2.952887  -11.4104
Mo S Ti
2 12 4
Cartesian
	0.0                  0.0                  -11.4104
	0.0                  0.0                  -34.2312
	-1.70485             -0.984294682371      -15.696836569199998
	0.0                  -1.968592317629      -12.8289637488
	0.0                  1.968592317629       -21.402036569199996
	1.70485              0.984294682371       -18.534163748799998
	0.0                  1.968592317629       -15.696836569199998
	1.70485              0.984294682371       -12.8289637488
	1.70485              -0.984294682371      -21.402036569199996
	-1.70485             0.984294682371       -18.534163748799998
	1.70485              -0.984294682371      -15.696836569199998
	-1.70485             0.984294682371       -12.8289637488
	-1.70485             -0.984294682371      -21.402036569199996
	0.0                  -1.968592317629      -18.534163748799998
	0.0                  0.0                  -5.7052
	0.0                  0.0                  -28.525999999999996
	0.0                  0.0                  -22.8208
	0.0                  0.0                  -17.1156
