16 Lattice="7.986217 0.0 0.0 0.0 6.952051 0.0 0.0 0.0 6.587766" Properties=species:S:1:pos:R:3:initial_charges:R:1 energy=-1043.787124 dipole="-8.22853767 -8.57477329 7.26338569" pbc="T T T" Ga 0.00000000 0.03100000 0.00310000 0.00000000 Ga 3.99310000 0.03100000 0.00310000 0.00000000 Ga 0.00000000 2.28630000 3.29700000 0.00000000 Ga 3.99310000 2.28630000 3.29700000 0.00000000 In 1.99660000 3.45400000 0.00280000 0.00000000 In 5.98970000 5.81540000 3.29670000 0.00000000 In 5.98970000 3.45400000 0.00280000 0.00000000 In 1.99660000 5.81540000 3.29670000 0.00000000 P 0.00000000 0.09830000 2.38580000 0.00000000 P 1.99660000 3.38770000 2.54910000 0.00000000 P 3.99310000 0.09830000 2.38580000 0.00000000 P 5.98970000 3.38770000 2.54910000 0.00000000 P 0.00000000 2.21900000 5.67970000 0.00000000 P 3.99310000 2.21900000 5.67970000 0.00000000 P 1.99660000 5.88170000 5.84290000 0.00000000 P 5.98970000 5.88170000 5.84290000 0.00000000