16 Lattice="7.946372 0.0 0.0 0.0 6.858871 0.0 0.0 0.0 6.538059" Properties=species:S:1:pos:R:3:initial_charges:R:1 energy=-1043.518728 dipole="-7.48246986 -4.45927503 8.07998186" pbc="T T T" Zn 0.00000000 -0.01840000 0.00480000 0.00000000 Zn 3.97320000 -0.01840000 0.00480000 0.00000000 Zn 0.00000000 2.30470000 3.27380000 0.00000000 Zn 3.97320000 2.30470000 3.27380000 0.00000000 Sn 1.98660000 3.43700000 0.00310000 0.00000000 Sn 5.95980000 5.70820000 3.27210000 0.00000000 Sn 5.95980000 3.43700000 0.00310000 0.00000000 Sn 1.98660000 5.70820000 3.27210000 0.00000000 P 0.00000000 0.10720000 2.37300000 0.00000000 P 1.98660000 3.31630000 2.52260000 0.00000000 P 3.97320000 0.10720000 2.37300000 0.00000000 P 5.95980000 3.31630000 2.52260000 0.00000000 P 0.00000000 2.17910000 5.64200000 0.00000000 P 3.97320000 2.17910000 5.64200000 0.00000000 P 1.98660000 5.82890000 5.79170000 0.00000000 P 5.95980000 5.82890000 5.79170000 0.00000000