32 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=65.14585281590932 stress="-0.005925661483301686 4.5024487745387477e-07 0.00013111694481145756 4.5024487745387477e-07 -0.006063084700958926 8.234307021208762e-05 0.00013111694481145756 8.234307021208762e-05 -0.005526211919694604" pbc="F F F" Pd 21.19273990 20.80722932 20.88066609 -3.84062618 -3.96990781 -4.58409859 Pd 22.55332204 22.38436473 21.23110688 -1.61427736 -4.61183766 -15.31164293 Pd 22.22772960 21.01283276 22.70071341 1.77245763 -14.91351864 -3.63824933 Pd 20.82858036 22.64720807 22.42827863 -19.14719805 -3.21510464 0.49671082 Pd 23.99633244 21.27559981 20.71321713 1.76798490 -8.41491362 -8.22992632 Pd 25.71736445 22.51614822 21.20384132 12.52307235 -3.62630809 -9.93343617 Pd 25.29224623 20.73214964 22.59607713 7.46103881 -11.50161384 -3.32862367 Pd 24.25551247 22.47973606 22.61222054 -1.63725471 -4.44010055 -4.52692883 Pd 21.06482696 24.02449008 21.01821382 -12.22855571 2.18723521 -14.38121124 Pd 22.41758316 25.46963223 21.15586213 1.45688597 11.66394774 -10.74693579 Pd 22.19697371 23.83226600 22.23049600 3.54837214 4.51203509 3.01475791 Pd 21.12036030 25.45631248 22.74843919 -12.04515665 10.44727786 -1.00547465 Pd 24.14432661 23.76023492 21.24849743 1.09155905 5.97407494 -17.98635675 Pd 25.75911890 25.69019325 21.19877714 3.14717617 2.14456764 -2.61647250 Pd 25.60881314 23.86492241 22.67286529 18.12755292 7.64520371 -3.38190527 Pd 24.06571811 25.35431870 22.29270493 0.97088854 12.39811563 1.90035791 Pd 21.13572127 21.05791531 23.73387496 -10.93644667 -9.50563092 4.03655324 Pd 22.58501927 22.73514727 24.00693356 -6.72691907 -2.43544525 -11.62832831 Pd 22.66501753 21.22580078 25.42866320 -4.24700984 -18.11086769 12.53690132 Pd 21.18883157 22.49955875 25.54313966 -16.10315004 -6.31599382 13.01286123 Pd 23.94832183 21.25980354 23.96667242 3.89046900 -20.62227602 0.61229565 Pd 25.77143892 22.40295338 24.10338854 19.54222086 -6.47605581 -0.75774104 Pd 25.74759167 21.11018303 25.42518197 3.51652990 -6.16113420 5.94459761 Pd 23.74663523 22.48702489 25.44857885 8.23097221 -8.60982331 24.91814404 Pd 21.18843096 23.97515400 24.41535555 -20.69979600 2.09877840 -3.03074287 Pd 22.46863002 25.44630638 24.03851086 2.37486411 15.37948851 -4.21340984 Pd 22.64982991 23.74795387 25.32929456 -3.83578098 8.51611916 22.82159332 Pd 20.78747849 25.39476746 25.37993804 -6.19888688 7.06210616 6.82716869 Pd 24.28095696 23.82464588 24.26008946 3.94077734 8.34397941 -4.75577755 Pd 25.37675974 25.32230465 24.24049451 10.94113980 15.92588251 -0.81127271 Pd 25.25346517 23.72069962 25.27715687 12.53775812 3.90874004 15.92608245 Pd 23.58696766 25.43198894 25.32743118 2.41933832 14.72297984 12.82051012