32 Lattice="36.90383529663086 0.0 0.0 0.0 36.90383529663086 0.0 0.0 0.0 36.90383529663086" Properties=species:S:1:pos:R:3:forces:R:3 energy=-30.31120503439887 stress="7.064149494621676e-07 2.6367994954381735e-05 -8.44190310973507e-05 2.6367994954381735e-05 -0.00022332000383077662 1.9213964518365367e-05 -8.44190310973507e-05 1.9213964518365367e-05 -0.00033483094574223045" free_energy=-30.31120503439887 pbc="F F F" N 18.37970001 18.32404674 18.34559461 1.78468938 2.91534723 1.21332338 N 19.62183547 19.69532143 18.22097115 -2.13466104 -0.69223238 2.78171756 N 19.67680146 18.24529615 20.14560723 1.52016996 -0.55888724 -0.45744210 N 18.50182215 19.52195964 19.90683745 -0.28924668 -0.91164685 -3.95112007 N 20.93312030 18.44228486 18.47923193 -4.10264682 -0.80237142 -2.00922449 N 22.32233312 19.66462957 18.41939826 2.01400359 4.06606457 -4.55232280 N 22.22439423 18.63370009 19.57587901 3.90583072 -5.27741042 3.44192688 N 21.24965785 19.62904924 19.67158841 -5.73604101 5.42160912 4.93568045 N 18.39608925 20.98551373 18.25807832 3.05867671 0.17020737 0.95052050 N 19.70042475 22.37683493 18.64013899 -1.49499851 -2.65007972 2.64060551 N 19.89556504 20.85969363 19.78743797 2.24459278 1.19045530 -5.06067078 N 18.26659561 22.55773504 19.66180554 2.32228857 -1.17781476 -1.02644766 N 21.28435469 21.11060731 18.26473556 -2.52223227 -3.52049025 -2.09507422 N 22.15836944 22.27996084 18.63594508 1.36466495 3.49415607 -3.22702394 N 22.23077472 21.27839198 19.70573802 5.33770283 -4.71996484 0.59098569 N 21.01039227 22.57513669 19.62678944 -5.00562377 2.41181546 1.06300332 N 18.56110497 18.53521139 21.30557885 -4.68070208 -6.81839372 -3.06634331 N 19.62681259 19.98013467 20.99595787 4.24764522 0.54150405 -2.40826680 N 19.80654927 18.50027113 22.42108703 4.60569013 -0.80291715 1.54585191 N 18.68717403 19.57759660 22.22448080 -1.86007470 3.57878806 4.69651373 N 21.10483118 18.37522493 21.10470382 -3.87777817 0.11204859 -5.43050708 N 22.30565648 20.16145775 20.98683187 1.63625608 -3.75351415 0.58914927 N 22.03870008 18.27239528 22.07474021 3.15842814 -0.29696125 3.07552217 N 21.20137323 19.57348893 22.51396848 -0.66358658 2.53186969 0.42369307 N 18.82767778 21.33771967 21.24090444 -4.29281393 2.66340845 0.10076725 N 19.73208629 22.46696614 21.25448691 2.90722973 2.32778533 0.42349764 N 19.88861573 20.98312138 22.39405369 2.95640864 0.74624484 3.92697977 N 18.25662470 22.31013001 22.65397045 1.02961650 -0.93028279 -1.49430283 N 21.19619337 20.97178644 21.23031931 -3.74496412 2.26419085 3.70946494 N 22.38099270 22.23225552 20.81675847 -0.21750641 1.22084195 2.42890960 N 22.28541193 21.23354863 22.62452782 -2.81375057 0.56836118 -1.84161190 N 20.96155669 22.58094462 22.58266443 -0.65726728 -3.31173114 -1.91775466