12
Lattice="5.97311086051685 0.0 0.0 0.0 5.702130313618985 0.0 0.0 0.0 5.70211501754576" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-55.40147646647343 pbc="T T T"
Pb       0.04812600      -0.14170718      -0.14134566       0.00000000
Br       3.06002628      -0.13121461      -0.13104439       0.00000000
Cl       0.18220079       2.75999292       0.03132563       0.00000000
Cl       0.18196546       0.03098775       2.76017396       0.00000000
N        2.47313617       2.15310939       2.15346426       0.00000000
H        1.83526459       2.71440585       1.54325174       0.00000000
H        1.83521779       1.54288667       2.71469134       0.00000000
H        2.96348436       1.49856340       1.49889249       0.00000000
C        3.39535914       2.96785229       2.96830276       0.00000000
H        4.02709369       2.30394948       3.57473286       0.00000000
H        2.81029655       3.62515069       3.62564232       0.00000000
H        4.02714280       3.57431448       2.30447343       0.00000000