16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-20.624122137122267 stress="0.0005446345451371185 3.5368360608173595e-05 2.825999929994724e-05 3.5368360608173595e-05 0.0005847808072760082 -2.4252067409252916e-06 2.825999929994724e-05 -2.4252067409252916e-06 0.000584664273275088" pbc="F F F" N 20.99216147 20.70926048 21.00502401 0.97063025 1.02750698 1.19054145 N 22.54010466 22.59679154 22.22930503 -1.66032562 3.38250936 -1.83758820 N 24.08775480 20.75965934 20.85903627 -0.61641091 1.13852181 1.13954969 N 25.56177401 22.69779826 22.56078392 -3.13999292 1.80610367 1.34885564 N 21.26942523 23.74886297 21.00849633 4.96389413 -0.86883964 5.19818010 N 22.24358210 25.24616570 22.37024753 -1.25625719 -5.38268431 -0.02827761 N 24.04369764 24.02991755 20.85495372 -1.23836088 -0.88364609 3.14160486 N 25.54955383 25.22555241 22.70713856 -1.99674416 -2.87357185 0.86231873 N 21.22849440 20.73737112 23.74753820 1.24381267 1.20723262 -0.97811597 N 22.55014340 22.56310271 25.70753235 0.88220260 1.43246045 -2.28914885 N 24.04958114 21.00124003 23.86414295 -0.22336584 2.71121073 -0.40966627 N 25.55134525 22.37076027 25.53052025 -1.90062246 0.56918262 -1.93853917 N 21.11475044 24.01156865 23.92756670 3.57554226 0.55175352 -1.87286295 N 22.61112704 25.24831061 25.75431947 0.71700400 -1.91918325 -1.67072670 N 24.08006198 23.85496639 24.08099246 0.72492526 -0.86298018 -0.86234955 N 25.39709891 25.73815320 25.55588641 -1.04593117 -1.03557644 -0.99377521