10
Lattice="0.0 3.985744 0.0 -7.404292999999998 1.9928720000000002 0.007147999999999998 -0.9456471957292777 1.992871999999999 11.006783343183754" Properties=species:S:1:pos:R:3:forces:R:3 energy=-50.92499212012175 stress="-0.0032348791094910234 4.039458720138684e-06 -4.051838008601129e-05 4.039458720138684e-06 0.011848729904997276 -2.4310020811266394e-06 -4.051838008601129e-05 -2.4310020811266394e-06 -0.002783568945646928" dipole="-0.0001080133886457789 0.6726833146953402 0.00010923701923652532" free_energy=-50.92501500110251 pbc="T T T"
I       -2.75389823       5.96061600      10.51596375       0.07489910       0.03152842       0.02369115
I       -5.30461005       3.99682600       7.81907356      -0.07771625       0.01501376       0.04169140
I       -1.90363038       2.00758200       6.65028487       0.05037037       0.01478339       0.07321153
I       -6.44631381       5.99332600       4.36365148      -0.05038370       0.01483296      -0.07325866
I       -3.04532413       3.99682200       3.19486277       0.07765124       0.01517783      -0.04167935
I       -5.59604596       1.97487200       0.49797261      -0.07490119       0.03134716      -0.02371730
Nb      -7.77656123       4.19978200       8.84634824      -0.02876268       0.68914641       0.05688456
Nb      -0.57338297       4.19977600       2.16757811       0.02892275       0.68911492      -0.05693173
O       -7.80408108       6.03419600       8.93450154       0.02539139      -0.74891254      -0.05821286
O       -0.54586313       2.04845200       2.07942481      -0.02528819      -0.74880002       0.05826079