30
Lattice="7.285024 -0.001487 0.000652 -3.643877 6.30503 -0.001307 0.001263 -0.002102 19.265491" Properties=species:S:1:pos:R:3:forces:R:3 energy=-111.8553481554603 stress="-0.00200227377384239 -8.660946419089674e-05 3.6046653870247074e-06 -8.660946419089674e-05 -0.0019958923362976863 -4.05316684639507e-05 3.6046653870247074e-06 -4.05316684639507e-05 -0.004344322835649136" dipole="-0.0045930446223620925 0.029989229194766966 104.09902266040028" pbc="T T T"
In       1.31711000       6.16866000       2.73508000      -0.00262694       0.00701709      -0.09641010
In       1.27131000       1.99435000       3.14266000      -0.02706418       0.02800433       0.07786109
In       2.62764000       4.22439000       5.88957000      -0.05067436       0.02050029       0.00283290
In      -1.08985000       2.10463000       6.35310000      -0.05443725      -0.00519656       0.07856375
In      -2.36976000       4.35723000       9.16305000      -0.00663820       0.02391493      -0.09244965
In       4.91149000       0.08829000       9.55052000       0.01017323      -0.05814519       0.08246148
In       2.32813000       0.12637000      12.37428000       0.00867007       0.01624352      -0.09727763
In       2.36850000       4.30860000      12.77508000       0.03562554      -0.02609148       0.07815026
In       1.01592000       2.07872000      15.52070000       0.05161649      -0.01728303      -0.00219174
In       4.73528000       4.20141000      15.98869000       0.04690467       0.00195467       0.06822880
In       6.01288000       1.94287000      18.79686000       0.00456157      -0.02453976      -0.09391048
In      -1.27856000       6.21118000      19.19927000       0.03433996       0.05094912       0.06055491
Se      -1.22611000       2.25327000       2.42417000       0.08848227      -0.02556000      -0.02809264
Se      -1.34887000       5.94550000       2.59779000       0.00892714       0.08177762      -0.02354446
Se       2.86448000       4.05868000       3.01681000      -0.06376334       0.00951644       0.01041691
Se       4.72928000       0.06137000       5.63065000       0.09489574       0.04700266      -0.02917787
Se       1.45927000       1.81361000       5.80431000      -0.04445004       0.03868022      -0.01720615
Se      -2.07742000       4.51114000       6.23330000      -0.01256396      -0.03979355       0.04650613
Se       2.30736000       4.10605000       8.82853000      -0.03231601       0.12533020      -0.03127928
Se      -0.84455000       2.16200000       9.01763000      -0.07475901      -0.04716956      -0.01753934
Se       2.33336000       0.44232000       9.44730000       0.00604025      -0.07653164       0.05853286
Se       4.86658000       4.04577000      12.05720000      -0.08446930       0.02606615      -0.03085190
Se       4.99431000       0.35462000      12.21842000      -0.02964352      -0.08628749      -0.01610491
Se       0.78012000       2.24101000      12.65003000       0.06796997      -0.02028123       0.01063624
Se      -1.08166000       6.24391000      15.26229000      -0.10117652      -0.05793679      -0.03044104
Se       2.18315000       4.49096000      15.43852000       0.05689023      -0.04286815      -0.02378277
Se       5.72092000       1.79245000      15.86790000       0.01550365       0.04649422       0.04556986
Se       1.33681000       2.19121000      18.46509000       0.01854764      -0.11356813      -0.03285812
Se       4.48630000       4.13795000      18.65198000       0.06613796       0.04049589      -0.01676083
Se       1.30509000       5.85924000      19.07943000      -0.03019613       0.07794179       0.06102173