32 Lattice="44.66860580444336 0.0 0.0 0.0 44.66860580444336 0.0 0.0 0.0 44.66860580444336" Properties=species:S:1:pos:R:3:forces:R:3 energy=-0.3354465909329969 stress="-0.00011371412711049322 -6.024300818339427e-06 -1.604431061337338e-05 -6.024300818339427e-06 -0.00012909560260950786 -4.3415889886168785e-05 -1.604431061337338e-05 -4.3415889886168785e-05 -9.677105139953605e-05" pbc="F F F" Kr 22.40003554 22.50230557 22.12364310 -0.09033928 0.01255911 -0.06696673 Kr 24.14432360 23.80050076 22.36765705 -0.95885889 0.52989811 0.00889181 Kr 23.60225757 22.15592957 23.84612847 0.19668650 0.00229511 -0.09815244 Kr 22.37061565 24.27385702 24.08453725 -0.42941060 -0.52613626 -0.17444356 Kr 25.43083461 22.44571635 22.37053651 0.48780585 -0.76575171 -0.15125029 Kr 27.11761303 24.02374478 22.34231604 -0.01704606 0.19944912 -0.09724767 Kr 27.01214226 22.42280231 23.62833943 0.29357404 -0.16574539 0.26650142 Kr 25.50969332 24.03214648 24.08301910 0.48144587 -2.50178635 -2.28745322 Kr 22.36478160 25.63015245 22.31976580 -2.10108926 -1.96731250 -0.62912804 Kr 23.63267893 26.77405632 22.68175947 2.49688050 1.96520616 0.20637326 Kr 24.01794469 25.30637655 24.10958096 -0.92132720 0.51279481 -0.74145184 Kr 22.16702924 27.23570883 23.87643732 -0.39458313 0.13811605 0.37536025 Kr 25.26168034 25.44658149 22.29833949 0.33984290 0.27883560 -0.02438131 Kr 27.07188510 27.22449069 22.39480036 -0.02138729 -0.03051537 0.01253656 Kr 27.31985753 25.71508722 24.14390440 0.08474898 -0.97746392 -0.99785457 Kr 25.61029853 27.11589050 24.16834088 -0.09493753 0.06226866 -0.27142094 Kr 22.35233398 22.41857458 25.44312828 -0.13241778 0.03287915 0.19365572 Kr 24.16941881 23.66296381 25.92007036 -0.18745818 0.49053140 -0.57855764 Kr 24.11334178 22.25881090 27.24696194 -0.04067423 -0.50584453 0.39568186 Kr 22.47625620 23.79363385 27.31602286 -0.04368113 0.04267772 0.00088302 Kr 25.43937245 22.15794627 25.06092130 0.01951719 -0.13420703 0.13610940 Kr 27.18948693 23.83124426 25.44339586 0.05239376 -0.05917866 -0.04983776 Kr 27.25281326 22.25424373 27.16120637 0.33324322 -0.32376166 -0.02615980 Kr 25.82844807 23.60515929 27.16490059 -0.26056607 0.34092894 0.09729989 Kr 22.39808053 25.72663908 25.51161949 -0.40357017 -0.10728899 -0.32062529 Kr 24.03391549 27.11245498 25.54757787 0.03199143 0.30031141 -0.18310252 Kr 23.78643831 25.66069437 26.90428737 0.50218173 -0.45134748 0.54418241 Kr 22.34302510 27.10354551 26.99046728 -0.20104796 0.36959523 0.23877253 Kr 25.43211341 25.28419186 25.28169548 0.96028604 2.30002645 3.17986451 Kr 27.21258633 26.98071889 25.47851458 0.06680779 0.88639713 1.03606992 Kr 27.18496979 25.29676721 27.04064394 0.07825014 0.01045424 0.01029834 Kr 25.80039341 26.92120640 27.16417567 -0.12726119 0.04111545 -0.00444729