0.016625 -0.011146 0.012880 -0.018387 -0.055329 0.048568 -0.015321 0.033625 0.004102 -0.016147 -0.020174 -0.010229 -0.007085 -0.004500 -0.016289 0.002950 0.028553 0.055649 0.071512 0.013388 -0.027995 -0.065189 -0.061802 0.033636 0.006953 0.030063 0.086190 0.001030 0.034758 0.022875 0.012339 -0.004838 -0.013430 0.068962 0.013221 0.054111 -0.021869 0.026137 -0.038962 -0.029593 0.018982 -0.010038 0.059634 0.013290 -0.112073 -0.032767 0.028129 -0.011895 -0.062992 -0.005837 0.004188 0.029025 -0.053665 0.012229 -0.023275 0.039607 0.047522 0.017132 -0.029478 -0.007776 -0.030280 -0.031019 -0.009871 -0.014512 0.069261 0.010554 -0.002795 0.012749 0.040686 -0.030933 0.030746 0.018253 0.023934 -0.025627 0.028945 0.026132 -0.011402 0.005150 0.006302 -0.033691 -0.017727 0.044919 0.003562 0.055222 -0.053761 0.019362 0.026968 -0.024434 -0.033296 -0.013235 0.022378 -0.003268 0.012021 -0.016397 0.009191 0.035068 -0.005257 0.047759 -0.019347 -0.023224 0.063959 0.005286 -0.060493 0.008685 0.006524 0.044008 0.009252 -0.047500 0.041693 -0.005714 0.043637 0.009957 0.005659 -0.004663 0.019239 0.035538 0.042120 -0.025957 0.045243 -0.109902 -0.008226 -0.026557 0.004147 -0.038845 -0.012065 -0.023657 -0.000580 -0.042658 -0.036112 0.006482 0.007732 -0.043157 -0.057293 0.023243 -0.040313 0.000921 -0.024140 -0.072457 -0.012064 0.001997 -0.043967 0.018578 0.022134 -0.025511 0.049920 0.041519 0.028681 -0.031215 -0.044612 -0.033519 0.012131 0.014634 0.035496 -0.009895 -0.054235 0.003834 0.008616 -0.035795 -0.110114 0.023768 0.052682 0.011464 0.042826 -0.019559 -0.046071 -0.016181 -0.057385 -0.049309 0.012689 -0.016872 0.056327 -0.023497 -0.016846 -0.011860 0.048677 0.033507 -0.024219 0.044760 0.032455 -0.006914 0.012332 -0.016682 -0.000466 0.006735 -0.011577 -0.127158 0.031619 0.062638 -0.061336 -0.008548 -0.053751 0.022481 0.037563 -0.016329 0.030381 0.085734 -0.038514 0.035717 -0.026569 0.014616 0.047664 -0.051442 -0.017376 -0.006446 -0.018520 -0.016859 -0.024760 0.043437 -0.019491 -0.010184 0.036197 -0.046465 0.013714 0.007266 -0.025469 -0.000411 0.000513 0.043937 0.022851 0.032591 0.027220 -0.054126 -0.051592 0.040325 -0.071933 -0.018002 -0.024045 -0.046575 -0.023313 0.053921 0.015032 0.011162 -0.000773 0.051073 0.010628 -0.030644 0.075430 -0.013882 0.070674 0.009890 0.078751 -0.082850 0.008310 0.042102 -0.013318 0.057377 -0.048788 -0.087274 0.028338 -0.010856 -0.032190 0.011960 0.027862 -0.020247 -0.021652 -0.009081 -0.044601 0.005260 0.007218 0.015351 0.036163 0.003156 0.038841 0.016188 -0.006426 0.043308 0.010727 0.009091 0.004206 0.011041 0.031173 0.012269 0.037770 0.005130 -0.022930 0.005356 0.009915 -0.027163 -0.057310 -0.054349 -0.013518 0.018917 -0.001047 0.023225 0.024104 -0.008824 0.004994 0.003837 0.047027 -0.375996 0.246697 -0.170486 -0.237399 -0.164305 0.072182 -0.852245 -0.007620 -0.259763 -0.098363 -0.269771 0.427430 0.019764 0.558054 0.622030 0.278438 0.103685 0.049813 -0.356735 0.212458 0.239739 -0.512771 -0.258992 0.261979 -0.531902 0.082709 -0.192536 -0.003474 0.427060 0.070343 -0.266778 0.109229 0.072206 0.475411 0.363718 -0.305789 0.177657 0.286830 -0.160939 0.424343 0.134624 -0.764242 -0.192513 0.117584 0.768948 0.185799 -0.342929 0.970303 -0.119388 0.770429 0.427852 -0.099283 0.260937 0.404999 0.556456 0.932604 -0.294659 0.651699 0.525001 0.500386 1.298477 -0.077259 -0.567654 -0.314576 -0.118241 0.114019 -0.081446 -0.483244 0.869688 0.052166 0.227561 -0.075013 -0.333471 0.031933 -0.244901 0.506322 -0.329166 -0.142162 -0.709415 0.438490 -0.534314 0.543448 0.220305 0.172141 0.884526 -0.040744 -0.384416 0.302732 0.066715 -0.207762 0.041028 0.800600 -0.201322 -0.156206 -0.842041 0.220049 0.388875 -1.038229 0.129599 -0.385750 0.306122 -0.781581 0.430874 0.279317 0.389321 0.109989 -0.466061 -0.085821 -0.074012 0.168177 -0.281599 -0.125792 -0.043485 0.436657 -0.017834 0.215927 -0.281853 0.098267 -0.772575 -0.654328 -0.110416 0.277423 0.291520 0.058224 0.206688 -0.125206 0.960976 -0.093599 -0.540064 -0.621578 0.092769 0.338000 -0.245392 -0.684840 -0.106025 -0.423505 0.664363 0.089429 -0.438391 -0.577452 -0.515816 0.104694 0.362876 0.314250 0.239618 0.445145 -0.072717 -0.286534 0.200187 0.034697 -0.163524 -0.562005 -0.198485 0.482580 -0.015781 -0.145694 0.365463 -0.335856 0.373454 -0.552094 0.208508 0.094191 0.455829 0.200266 0.102931 -0.507001 -0.673158 0.043717 -0.339935 -0.409572 -0.378970 -0.231782 -0.292414 0.209572 0.145290 -0.508386 -0.343764 -0.225566 0.439322 0.099426 -0.061400 0.197317 0.420276 -0.049859 -0.698332 0.043160 0.060381 -0.368558 -0.492388 -0.279998 0.145618 0.793196 -1.145263 -7.271518 -0.096384 0.255436 -0.076746 -0.581414 0.034502 -0.056580 0.113977 0.182493 -0.448545 -0.166284 -0.072457 -0.503458 -1.761111 1.830793 2.423388 0.846784 -0.433838 2.287237 0.336782 -0.284288 3.251531 0.121205 -0.153595 -0.704329 -0.012384 -0.053360 0.314937 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 vasp 5.4.4 18Apr17-6-g9f103f2a35 (build Apr 26 2024 11:19:37) complex LinuxIFC 2024-04-29T12:57:50.000 14.541899 14.541899 22.0 90.0 90.0 90.0 10525.110800000024 0 2 450 0.1E-04 -.3E-01 2 0.1500 0.0 1831.0000 -1.0000 0 0.03 T 3 PE 8 0 false F 0.0000 2 PAW_PBE Cu 22Jun2005|PAW_PBE O 08Apr2002|PAW_PBE C 08Apr2002|PAW_PBE H 15Jun2001 Cu O C H 63.55 16.00 12.01 1.00 11.00 6.00 4.00 1.00 165 1 2 2 14.541899 14.541899 22.0 90.0 90.0 90.0 10525.110800000024