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3.779219 0.615774 C 8.153331 2.981882 0.240982 0.081240 C 10.056800 27.339028 3.722195 -0.031947 C 15.924337 -1.264630 4.822377 0.199990 C 9.851540 28.671290 3.766882 -0.086821 C 7.530271 28.413293 4.049262 0.191143 C 13.565012 -1.538460 4.693525 -0.095921 C 8.953915 26.513904 3.868320 -0.098241 C 8.613682 29.223697 3.912184 -0.159446 C 7.693673 27.086887 3.988948 -0.163782 C 14.462644 0.405256 5.707896 -0.102750 C 14.854354 -1.937334 4.402921 -0.157696 C 15.696024 -0.082256 5.384394 -0.153276 C -5.048239 -4.584122 22.088351 -0.155372 C -6.875043 -6.025128 21.693569 -0.149313 C -8.593512 -2.536940 17.738617 0.628224 C -8.617027 -3.013699 16.321238 -0.030619 C -6.345422 -4.732911 21.695762 0.026629 C 14.227934 26.351211 6.126256 0.623946 C -6.100766 -7.071686 22.096028 0.087464 C -7.148351 -3.563526 21.230248 0.615732 C -4.320074 -5.692094 22.479844 0.081266 C 14.297784 26.666998 7.572969 -0.031935 C 24.927419 -3.879370 13.683050 0.199997 C 13.701689 25.901395 8.509755 -0.086785 C 25.558636 -4.325758 10.256119 0.191003 C -7.628533 -2.658997 15.451346 -0.095972 C 26.127188 -3.835105 7.997086 -0.098268 C 24.927387 -5.455898 9.839404 -0.159407 C 26.178683 -3.553349 9.356892 -0.163724 C 23.904463 -3.792294 15.840645 -0.102775 C 25.943679 -3.168678 14.168303 -0.157633 C 23.987276 -4.235497 14.552119 -0.153289 C 19.745248 1.626530 19.034819 -0.155358 C 18.995586 -0.576123 19.429601 -0.149248 C -10.719545 -1.033521 23.384554 0.628153 C -11.161181 -1.214583 24.801932 -0.030588 C 20.037363 0.353944 19.427408 0.026556 C -2.282886 14.283782 7.581468 0.624088 C 17.750785 -0.194983 19.027143 0.087431 C -12.169182 -0.013266 19.892922 0.615777 C 18.457916 1.943724 18.643326 0.081276 C -2.008461 14.454872 6.134755 -0.031961 C -0.774447 14.294474 0.024674 0.200006 C -2.531596 13.637652 5.197969 -0.086770 C -1.405664 14.740863 3.451605 0.191062 C -11.156247 -0.164372 25.671825 -0.095938 C -1.132556 15.440492 5.710638 -0.098283 C -2.260752 13.769013 3.868320 -0.159478 C -0.884097 15.582933 4.350831 -0.163727 C -11.543510 -2.468965 25.282525 -0.102734 C -11.635267 -0.338470 26.954867 -0.157680 C -11.988952 -2.538597 26.571051 -0.153308 C 10.686652 0.597631 12.232498 -0.155336 C 11.652546 2.647381 11.572883 -0.149338 C 7.351798 3.415334 8.155821 0.628173 C 6.427102 4.562566 8.411882 -0.030585 C 10.868635 1.534970 11.259250 0.026626 C -0.970254 11.759204 10.110817 0.624095 C 12.216419 2.747743 12.809319 0.087474 C 10.204926 1.402633 9.928504 0.615758 C 11.285894 0.767005 13.466742 0.081204 C 0.038833 10.680509 9.985528 -0.031942 C 4.691869 6.678014 8.885346 0.199982 C 1.363323 10.931069 9.940841 -0.086772 C 1.893824 8.656550 9.658462 0.191087 C 5.220135 4.362345 9.014199 -0.095961 C -0.371480 9.365656 9.839404 -0.098273 C 2.296750 9.948135 9.795539 -0.159457 C 0.588809 8.368477 9.718776 -0.163763 C 6.753470 5.856520 7.999827 -0.102715 C 4.414300 5.444999 9.304803 -0.157655 C 5.882720 6.856868 8.323330 -0.153315 N 3.329455 13.856416 23.887353 -0.231443 N 0.559634 -2.304547 4.622244 -0.147934 N -10.728740 28.456027 3.777849 -0.146786 N 0.761919 15.671851 17.235817 -0.231418 N -2.359171 23.501841 9.085479 -0.147900 N -3.171723 23.112474 9.929875 -0.146799 N 23.054548 14.972477 8.426138 -0.231405 N -6.518228 6.518211 15.495211 -0.147928 N -6.753257 7.648351 15.933858 -0.146797 N 17.623623 18.812692 5.281586 -0.231433 N -2.873979 3.941471 25.627960 -0.147871 N -1.730135 4.096583 25.189313 -0.146805 N 14.521613 29.587109 3.471892 -0.231405 N -10.632482 -10.672720 27.100169 -0.147928 N 0.463383 4.871937 0.882777 -0.146797 N 11.954100 22.919009 5.225384 -0.231433 N 8.832974 11.945589 2.519480 -0.147871 N 8.020420 12.871539 2.434492 -0.146805 N 0.670096 15.639337 10.235831 -0.231443 N 15.866182 -5.667957 14.023001 -0.147934 N 15.631136 -5.853158 12.824946 -0.146786 N -4.760853 10.995951 8.482339 -0.231417 N 19.510393 4.395605 11.188244 -0.147900 N 20.654238 3.938170 11.273232 -0.146799 N 25.713724 4.041422 0.056202 -0.231418 N 11.752050 12.977783 23.108480 -0.147900 N 11.655799 14.156983 22.754821 -0.146798 N 23.146278 8.894087 4.954245 -0.231442 N -13.551404 12.037518 15.810488 -0.147934 N 19.212733 11.500933 15.051080 -0.146785 N 11.862324 16.873133 8.753478 -0.231433 N 4.674043 -0.849737 25.312682 -0.147871 N 4.439007 -1.794675 26.072090 -0.146805 N 6.431441 17.676304 13.651522 -0.231405 N 8.318156 -8.336559 18.014690 -0.147928 N 9.462006 -8.034236 18.368349 -0.146797 N 8.925374 -1.972006 3.528094 -0.231419 N -5.036300 13.523854 22.793203 -0.147900 N -5.132551 12.627984 23.637598 -0.146799 N 6.357928 -0.156445 10.179630 -0.231443 N 3.236946 7.673698 18.329968 -0.147934 N 2.424383 7.284316 17.485572 -0.146786 N -4.926026 -0.855653 18.989309 -0.231434 N -12.114307 22.346407 11.920236 -0.147870 N -12.349343 23.476538 11.481589 -0.146805 N -10.356909 2.984621 22.133861 -0.231406 N 25.106506 19.769475 1.787487 -0.147928 N -7.326344 19.924596 2.226134 -0.146797 N -13.458895 13.759073 23.943555 -0.231444 N 17.347984 5.155257 0.315278 -0.147934 N 6.059610 -10.956050 26.532670 -0.146785 N -16.026431 7.090939 22.190063 -0.231418 N 14.429179 -3.882430 24.895967 -0.147900 N 13.616627 -2.956478 24.980955 -0.146799 N 6.266198 -0.188827 17.179616 -0.231406 N 10.270122 10.160267 13.392446 -0.147928 N 10.035093 9.975088 14.590501 -0.146797 N 0.835273 -4.832180 18.933108 -0.231434 N 13.914371 20.223882 16.227203 -0.147870 N 15.058215 19.766445 16.142215 -0.146805 N -2.266737 -11.786550 27.359245 -0.231406 N 6.155868 28.805835 4.306967 -0.147928 N 17.251733 -1.671417 4.660626 -0.146797 N -4.834250 -6.933977 22.461202 -0.231434 N 25.621324 -3.790752 11.604959 -0.147871 N 24.808770 -4.327321 12.364367 -0.146805 N 17.458446 1.044997 18.661969 -0.231443 N -0.922168 14.978273 2.102765 -0.147934 N -1.157214 14.033321 1.343357 -0.146786 N 12.027497 1.848076 13.763925 -0.231418 N 2.722043 7.491590 9.400757 -0.147900 N 3.865888 7.793906 9.047098 -0.146799 O 4.055393 10.333559 27.355133 -0.582007 O 16.634247 27.543838 2.988558 -0.583471 O 14.255662 27.854845 1.037401 -0.573242 O 5.927007 -0.145235 7.182299 -0.578968 O 17.415452 25.663752 2.049305 -0.591327 O 6.756783 -0.874935 5.231964 -0.594508 O -2.801489 15.181934 13.768037 -0.582020 O -1.960518 16.950077 10.719166 -0.583469 O -0.874419 14.811227 12.670323 -0.573249 O 9.079622 -2.374489 6.525425 -0.578965 O -3.993469 17.059934 11.658419 -0.591351 O 8.115090 -1.835362 8.475760 -0.594510 O -6.271996 14.976775 11.052812 -0.581995 O -4.896481 11.641295 11.387006 -0.583474 O -5.843350 13.681692 9.265324 -0.573250 O -7.234978 1.070481 18.630989 -0.578947 O -5.037486 13.068701 13.110341 -0.591311 O -8.760020 2.291797 19.729801 -0.594512 O 16.210937 22.821166 2.654912 -0.581976 O 12.607708 23.006195 2.320718 -0.583504 O 14.847063 22.793642 4.442399 -0.573220 O -7.771283 1.449761 22.492181 -0.578917 O 14.000459 23.349018 0.597383 -0.591374 O -6.111486 0.419017 21.393370 -0.594421 O 26.439679 2.695276 4.788930 -0.581996 O 27.826386 4.644497 2.067399 -0.583473 O 25.447810 2.799249 2.773621 -0.573250 O -5.265151 -9.535333 23.950134 -0.578947 O 28.607619 4.771142 4.165229 -0.591311 O -4.435353 -10.859507 25.557228 -0.594512 O 8.390721 20.160802 7.383528 -0.581976 O 9.231692 16.636330 7.376674 -0.583504 O 10.317802 19.395515 8.253420 -0.573221 O -2.112505 -8.989554 26.209167 -0.578917 O 7.198733 17.394814 6.811916 -0.591374 O -3.077056 -7.570092 24.767115 -0.594421 O 4.920235 17.911942 8.918793 -0.582007 O 6.295786 19.869128 11.640325 -0.583471 O 5.348907 17.011493 10.934103 -0.573242 O 15.149473 -0.228398 17.173036 -0.578969 O 6.154753 20.647857 9.542495 -0.591327 O 13.624410 0.112527 15.565942 -0.594508 O -6.173568 6.716927 6.324195 -0.582020 O 23.799903 6.334992 6.331049 -0.583469 O 26.039247 8.278690 5.454303 -0.573249 O 14.613139 2.925831 14.914003 -0.578966 O 25.192662 4.671134 6.895807 -0.591351 O 16.272955 2.489618 16.356056 -0.594510 O 15.247505 -13.028318 22.686831 -0.582020 O 5.442096 15.296612 22.359490 -0.583469 O 3.063537 16.830854 23.604426 -0.573249 O -16.457312 9.681085 23.698461 -0.578966 O 6.223313 17.050052 21.200913 -0.591351 O -15.627509 11.734959 24.041702 -0.594510 O 19.582916 12.142210 6.263881 -0.582007 O 20.423927 13.898540 9.319607 -0.583471 O 21.510000 13.278205 6.491704 -0.573242 O -13.304687 11.364561 22.096302 -0.578969 O 18.390964 13.030199 8.945112 -0.591327 O -14.269245 9.405971 21.588020 -0.594508 O 16.112445 14.596230 7.443842 -0.581976 O 17.487956 15.974524 4.388116 -0.583504 O 16.541115 16.791762 7.216020 -0.573221 O 3.957250 -0.841566 19.026869 -0.578917 O 17.346928 13.768389 4.762611 -0.591374 O 2.432194 -2.403807 19.535151 -0.594421 O 5.018790 17.946854 18.436340 -0.581996 O 1.415566 18.143760 18.763680 -0.583473 O 3.654893 16.412615 17.518745 -0.573250 O 3.420894 -4.375075 17.424710 -0.578947 O 2.808340 19.464795 19.922257 -0.591311 O 5.080705 -2.908118 17.081468 -0.594512 O -1.540845 26.161531 0.060314 -0.582020 O -11.346254 11.715811 24.426889 -0.583469 O -13.724813 12.026854 26.378046 -0.573249 O 0.331038 15.683117 20.233148 -0.578966 O -10.565037 9.835743 25.366142 -0.591351 O 1.160841 14.953454 22.183483 -0.594510 O 2.794566 -0.646296 13.647410 -0.582007 O 3.635577 1.121904 16.696281 -0.583471 O 4.721650 -1.016983 14.745124 -0.573243 O 3.483663 13.453875 20.890022 -0.578969 O 1.602614 1.231743 15.757028 -0.591327 O 2.519105 13.992967 18.939687 -0.594508 O -0.675905 -0.851404 16.362635 -0.581976 O 0.699606 -4.186890 16.028441 -0.583505 O -0.247235 -2.146453 18.150123 -0.573221 O 20.745600 16.898617 8.784458 -0.578917 O 0.558578 -2.759517 14.305106 -0.591373 O 19.220544 18.119913 7.685646 -0.594421 O -11.769560 6.993145 24.760535 -0.581995 O -15.372784 7.178180 25.094729 -0.583474 O -13.133457 6.965587 22.973048 -0.573250 O 20.209244 17.277825 4.923266 -0.578947 O -13.980010 7.521036 26.818064 -0.591311 O 21.869055 16.247101 6.022077 -0.594512 O -12.732957 18.523674 22.626517 -0.582007 O -0.154103 -11.183513 25.348048 -0.583471 O -2.532688 -13.028775 24.641826 -0.573243 O 22.715357 6.292704 3.465313 -0.578969 O 0.627102 -11.056907 23.250218 -0.591327 O 23.545133 4.968499 1.858219 -0.594508 O 13.986861 4.332692 20.031919 -0.582020 O 14.827832 0.808220 20.038773 -0.583469 O 15.913931 3.567389 19.162027 -0.573249 O 25.867972 6.838440 1.206280 -0.578966 O 12.794881 1.566714 20.603531 -0.591351 O 24.903440 8.257929 2.648332 -0.594511 O 10.516354 2.083803 18.496654 -0.581995 O 11.891869 4.040937 15.775122 -0.583474 O 10.945000 1.183316 16.481344 -0.573250 O 9.553372 15.599766 10.242411 -0.578947 O 11.750864 4.819706 17.872952 -0.591311 O 8.028330 15.940722 11.849505 -0.594512 O -0.577413 -9.111163 21.091252 -0.581977 O -4.180642 -9.493098 21.084398 -0.583505 O -1.941287 -7.549384 21.961144 -0.573222 O 9.017067 18.754037 12.501444 -0.578917 O -2.787891 -11.156967 20.519640 -0.591373 O 10.676864 18.317798 11.059391 -0.594421 O 9.651329 2.799742 4.728616 -0.581996 O 11.038036 -0.531781 5.055957 -0.583474 O 8.659460 1.002438 3.811021 -0.573250 O 11.523199 25.509126 3.716986 -0.578947 O 11.819269 1.221681 6.214534 -0.591311 O 12.352997 27.562994 3.373745 -0.594512 O -8.397629 -3.685879 21.151566 -0.581977 O -7.556658 -1.929607 18.095840 -0.583504 O -6.470548 -2.549889 20.923743 -0.573221 O 14.675845 27.192632 5.319145 -0.578917 O -9.589617 -2.797940 18.470335 -0.591374 O 13.711294 25.234052 5.827427 -0.594421 O 21.708585 -1.231881 19.971605 -0.582007 O -10.492564 0.146470 23.027331 -0.583470 O -11.439443 0.963655 20.199427 -0.573242 O -1.638877 14.986563 8.388578 -0.578968 O -10.633597 -2.059672 22.652836 -0.591327 O -3.163940 13.424312 7.880296 -0.594508 O 10.614782 2.118535 8.979107 -0.582020 O 7.011553 2.315435 8.651767 -0.583469 O 9.250897 0.584313 9.896702 -0.573249 O -2.175211 11.453085 9.990737 -0.578966 O 8.404312 3.636448 7.493190 -0.591351 O -0.515395 12.920048 10.333979 -0.594510 O 14.488687 25.368563 2.816663 -1.032990 O -3.296209 14.202140 10.891060 -1.033055 O 25.680852 5.583288 4.037199 -1.033051 O 7.896032 18.159186 9.670525 -1.032991 O 3.296538 16.533096 20.561585 -1.033053 O 19.088234 15.123621 6.853862 -1.032993 O -13.491812 9.540539 24.598784 -1.033056 O 2.299884 -1.626036 16.524387 -1.032995 O -2.299663 -10.244759 23.378248 -1.032995 O 13.492141 2.331032 17.744922 -1.033057 O 8.892502 0.704737 6.853862 -1.033057 O -8.892318 -0.704479 20.561585 -1.032989 The following XYZ coordinates are in angstroms. Other properties are in atomic units. The sperically averaged electron density of each atom fit to a function of the form exp(a - br) eigen_1, eigen_2 and eigen_3 are the three eigenvalues of traceless quadrupole moment tensor atom number atomic symbol X Y Z net charge C6 coefficient C8 coefficient C10 coefficient fluctuating dipole atomic polarizability isotropic forcefield polarizability a b squared Pearson coefficient wp_QDO m_QDO q_QDO dipole_x dipole_y dipole_z dipole Qxy Qxz Qyz Q(x^2-y^2) Q(3z^2 - R^2) eigen_1 eigen_2 eigen_3 static polarizability alpha(xx) alpha(xy) alpha(xz) alpha(yy) alpha(yz) alpha(zz) atomic spin moment 1 In 14.498994 27.373686 3.157711 1.444474 174.934221 0.37101604E+04 0.13533039E+06 20.596259 16.125514 0.921836 2.018487 0.997146 72.848028 190.148730 0.638907 0.262824 -1.315308 0.003888 -0.062356 -0.014113 0.064051 -0.016517 0.060679 -0.010437 0.102631 0.075032 -0.066428 -0.028888 0.095316 27.446298 25.928684 1.925913 -3.992158 30.391620 -3.062700 26.018590 0.000988 2 In -1.409198 14.880218 10.550012 1.444516 174.925664 0.37100220E+04 0.13532334E+06 20.594879 16.124532 0.921943 2.018528 0.997147 72.846105 190.138912 0.638971 0.262802 -1.315343 -0.060072 -0.017134 0.014090 0.064037 -0.045096 0.030235 -0.053513 -0.059004 0.075024 -0.066416 -0.028780 0.095196 27.444384 28.681094 2.898832 1.556033 27.634065 4.785144 26.017994 0.000988 3 In -3.966413 12.663625 9.741805 1.444504 174.924383 0.37100118E+04 0.13532179E+06 20.593756 16.123408 0.922053 2.018558 0.997148 72.845412 190.131251 0.639063 0.262766 -1.315398 0.016610 0.047903 0.039199 0.064087 -0.041757 0.020718 -0.066936 -0.026434 0.061120 -0.066216 -0.028947 0.095163 27.443185 32.111710 3.817052 -0.373575 24.619015 2.054538 25.598830 0.000989 4 In 13.261574 24.223876 3.965919 1.444453 174.989209 0.37113536E+04 0.13538925E+06 20.603911 16.131082 0.922256 2.018600 0.997151 72.853268 190.193611 0.638599 0.262921 -1.315143 0.039579 0.031583 -0.039185 0.064027 -0.024149 0.070251 0.003080 0.073019 0.061314 -0.066518 -0.028834 0.095352 27.457193 23.062449 0.613394 -2.062888 33.697144 -0.333264 25.611986 0.000987 5 In 25.691133 4.876064 2.130180 1.444503 174.924318 0.37100122E+04 0.13532180E+06 20.593744 16.123404 0.922058 2.018560 0.997148 72.845426 190.131246 0.639064 0.262766 -1.315399 0.003888 0.018992 0.061086 0.064088 0.060806 -0.015873 -0.032982 0.026964 -0.151810 -0.066218 -0.028945 0.095164 27.443154 25.926024 -4.418930 0.328966 29.760208 3.424361 26.643230 0.000988 6 In 9.783037 17.524786 9.253810 1.444453 174.989210 0.37113538E+04 0.13538926E+06 20.603913 16.131084 0.922254 2.018600 0.997151 72.853265 190.193617 0.638599 0.262921 -1.315143 -0.060075 0.020740 0.007760 0.064027 0.048757 0.024135 0.023606 -0.111343 -0.081812 -0.066517 -0.028835 0.095352 27.457196 28.697548 -0.100922 -3.291106 22.286726 -1.694122 31.387313 0.000988 7 In 7.225853 17.933177 11.577543 1.444474 174.934258 0.37101611E+04 0.13533043E+06 20.596264 16.125517 0.921835 2.018487 0.997146 72.848031 190.148755 0.638907 0.262824 -1.315308 0.016575 0.009985 -0.061058 0.064051 0.038820 0.026000 0.026200 -0.097415 -0.151956 -0.066428 -0.028888 0.095315 27.446306 32.116310 -2.232653 -3.119710 23.576563 -1.451019 26.646045 0.000988 8 In 24.453744 7.150920 4.453914 1.444516 174.925532 0.37100195E+04 0.13532323E+06 20.594865 16.124524 0.921944 2.018529 0.997147 72.846085 190.138829 0.638971 0.262802 -1.315343 0.039605 -0.049714 -0.007794 0.064038 0.072898 -0.013978 -0.030331 0.025351 -0.082026 -0.066416 -0.028780 0.095196 27.444354 23.053426 -2.091493 0.499946 27.905636 3.664663 31.374001 0.000988 9 In 3.306840 15.235196 22.127556 1.444516 174.925623 0.37100215E+04 0.13532332E+06 20.594873 16.124528 0.921944 2.018529 0.997147 72.846105 190.138891 0.638971 0.262802 -1.315343 0.003870 0.043376 -0.046951 0.064038 -0.044155 -0.044582 0.043788 0.045218 -0.097067 -0.066417 -0.028779 0.095197 27.444369 25.928363 2.495115 3.663988 24.458352 -0.360646 31.946391 0.000988 10 In 20.975250 15.079943 7.611625 1.444474 174.934305 0.37101614E+04 0.13533044E+06 20.596270 16.125520 0.921833 2.018486 0.997146 72.848020 190.148742 0.638907 0.262825 -1.315307 -0.060085 -0.003663 -0.021882 0.064051 -0.003489 -0.054090 0.030323 -0.018519 0.196659 -0.066427 -0.028888 0.095315 27.446316 28.685247 -2.798515 1.733498 30.566386 -3.092401 23.087316 0.000989 11 In 18.418045 16.888145 6.096099 1.444453 174.989279 0.37113547E+04 0.13538931E+06 20.603920 16.131087 0.922254 2.018600 0.997151 72.853270 190.193647 0.638599 0.262921 -1.315143 0.016585 -0.057857 0.021842 0.064028 0.003100 -0.046396 0.041182 0.018733 0.196820 -0.066517 -0.028835 0.095352 27.457210 32.130032 -1.586202 3.494265 27.146920 -0.602648 23.094676 0.000988 12 In 2.069409 16.110151 18.995615 1.444503 174.924326 0.37100123E+04 0.13532180E+06 20.593746 16.123405 0.922056 2.018559 0.997148 72.845428 190.131264 0.639064 0.262766 -1.315398 0.039626 0.018134 0.046989 0.064087 -0.048549 -0.055939 0.027659 0.020328 -0.097045 -0.066218 -0.028946 0.095164 27.443158 23.052362 1.478335 1.562623 27.330567 -3.332157 31.946545 0.000988 13 In -13.481510 11.545656 24.257736 1.444516 174.925631 0.37100212E+04 0.13532331E+06 20.594876 16.124529 0.921942 2.018528 0.997147 72.846103 190.138902 0.638971 0.262802 -1.315343 0.003870 -0.062349 0.014089 0.064038 -0.016531 -0.060531 0.010670 0.102581 0.075024 -0.066416 -0.028780 0.095196 27.444375 25.928387 1.925610 3.992804 30.386735 3.062084 26.018003 0.000988 14 In 4.186900 -0.947952 16.865435 1.444474 174.934353 0.37101623E+04 0.13533048E+06 20.596274 16.125522 0.921832 2.018486 0.997146 72.848031 190.148774 0.638907 0.262825 -1.315308 -0.060086 -0.017119 -0.014113 0.064051 -0.045099 -0.030067 0.053730 -0.059063 0.075031 -0.066428 -0.028888 0.095316 27.446320 28.685241 2.900495 -1.556873 27.635107 -4.784752 26.018612 0.000989 15 In 1.629695 -3.164530 17.673642 1.444453 174.989266 0.37113543E+04 0.13538929E+06 20.603919 16.131086 0.922252 2.018600 0.997151 72.853265 190.193628 0.638599 0.262921 -1.315143 0.016585 0.047843 -0.039184 0.064027 -0.041730 -0.020513 0.067260 -0.026436 0.061314 -0.066517 -0.028835 0.095352 27.457203 32.130039 3.819223 0.373410 24.629592 -2.055966 25.611979 0.000988 16 In -14.718941 8.395831 23.449528 1.444504 174.924435 0.37100131E+04 0.13532184E+06 20.593759 16.123410 0.922054 2.018558 0.997148 72.845424 190.131285 0.639063 0.262766 -1.315398 0.039626 0.031627 0.039199 0.064086 -0.024170 -0.070015 -0.002779 0.073049 0.061121 -0.066216 -0.028947 0.095163 27.443185 23.052368 0.614119 2.061547 33.678361 0.332615 25.598826 0.000988 17 In -2.289356 -10.951947 25.285267 1.444474 174.934366 0.37101624E+04 0.13533049E+06 20.596273 16.125521 0.921832 2.018486 0.997146 72.848038 190.148787 0.638907 0.262824 -1.315308 0.003889 0.018956 -0.061059 0.064052 0.060808 0.016036 0.033246 0.026968 -0.151961 -0.066429 -0.028888 0.095316 27.446323 25.928736 -4.420285 -0.328122 29.764209 -3.424976 26.646024 0.000988 18 In 15.379152 1.696641 18.161637 1.444517 174.925730 0.37100228E+04 0.13532338E+06 20.594888 16.124535 0.921941 2.018528 0.997147 72.846106 190.138938 0.638970 0.262802 -1.315343 -0.060073 0.020769 -0.007795 0.064038 0.048732 -0.023936 -0.023289 -0.111355 -0.082026 -0.066416 -0.028780 0.095196 27.444399 28.681108 -0.101815 3.288497 22.278003 1.692874 31.374087 0.000988 19 In 12.821937 2.104987 15.837904 1.444504 174.924418 0.37100125E+04 0.13532182E+06 20.593758 16.123408 0.922053 2.018558 0.997148 72.845427 190.131295 0.639064 0.262766 -1.315398 0.016610 0.009996 0.061085 0.064088 0.038820 -0.025803 -0.025960 -0.097409 -0.151809 -0.066217 -0.028947 0.095164 27.443188 32.111743 -2.232025 3.118902 23.574630 1.451557 26.643192 0.000988 20 In -3.526776 -8.677135 22.961533 1.444453 174.989286 0.37113543E+04 0.13538929E+06 20.603920 16.131085 0.922252 2.018600 0.997151 72.853273 190.193653 0.638599 0.262921 -1.315143 0.039578 -0.049726 0.007760 0.064026 0.072913 0.014211 0.030623 0.025309 -0.081812 -0.066517 -0.028835 0.095352 27.457210 23.062460 -2.093194 -0.500191 27.921831 -3.667595 31.387340 0.000988 21 In 8.902783 -0.593192 5.287891 1.444504 174.924461 0.37100131E+04 0.13532184E+06 20.593759 16.123408 0.922054 2.018558 0.997148 72.845433 190.131299 0.639064 0.262766 -1.315398 0.003888 0.043405 0.046990 0.064088 -0.044150 0.044723 -0.043521 0.045220 -0.097043 -0.066218 -0.028946 0.095164 27.443189 25.926085 2.494301 -3.662480 24.456876 0.362524 31.946606 0.000988 22 In -7.005313 -0.748172 19.803822 1.444453 174.989098 0.37113526E+04 0.13538920E+06 20.603900 16.131079 0.922256 2.018601 0.997151 72.853260 190.193573 0.638599 0.262921 -1.315143 -0.060075 -0.003649 0.021841 0.064026 -0.003476 0.054292 -0.030015 -0.018466 0.196818 -0.066518 -0.028834 0.095352 27.457167 28.697540 -2.799703 -1.732925 30.579331 3.093530 23.094630 0.000988 23 In -9.562497 1.060059 21.319348 1.444474 174.934193 0.37101607E+04 0.13533041E+06 20.596256 16.125515 0.921836 2.018487 0.997146 72.848026 190.148725 0.638907 0.262824 -1.315308 0.016575 -0.057871 -0.021882 0.064051 0.003108 0.046619 -0.040890 0.018790 0.196660 -0.066429 -0.028887 0.095316 27.446287 32.116269 -1.585436 -3.493367 27.135306 0.603571 23.087287 0.000988 24 In 7.665394 0.281822 8.419832 1.444516 174.925685 0.37100217E+04 0.13532333E+06 20.594881 16.124531 0.921942 2.018528 0.997147 72.846107 190.138922 0.638971 0.262802 -1.315343 0.039605 0.018107 -0.046951 0.064038 -0.048554 0.056144 -0.027436 0.020336 -0.097065 -0.066416 -0.028780 0.095196 27.444388 23.053434 1.478660 -1.561309 27.333303 3.334265 31.946426 0.000988 25 In 15.668783 24.534085 1.371321 1.333764 156.451947 0.33315807E+04 0.12153987E+06 20.833832 16.460568 0.389339 1.822957 0.998817 81.134768 231.366761 0.550512 0.304979 -1.233459 -0.107309 0.075860 0.131373 0.185819 0.048694 0.210500 -0.115565 0.022213 -0.083093 -0.266622 0.047173 0.219449 27.392660 24.539579 6.096862 3.187037 35.269457 -5.959415 22.368942 0.285004 26 In -4.476305 15.036618 12.336403 1.333778 156.456808 0.33316531E+04 0.12154349E+06 20.834526 16.460908 0.389263 1.822939 0.998816 81.134873 231.369993 0.550497 0.304985 -1.233450 0.107317 -0.075846 -0.131393 0.185832 0.030807 0.179642 -0.159193 -0.078761 -0.083303 -0.266615 0.047407 0.219208 27.393969 30.246315 8.114969 6.681945 29.565396 -1.018011 22.370194 0.285005 27 In 26.860967 4.748837 5.482541 1.333771 156.463081 0.33318053E+04 0.12155054E+06 20.835116 16.461317 0.389250 1.822929 0.998816 81.136232 231.375948 0.550488 0.304987 -1.233448 -0.107325 0.075908 -0.131409 0.185874 0.158025 -0.146998 0.071634 -0.055005 -0.314620 -0.266677 0.047437 0.219241 27.394822 24.541617 -0.287821 -6.873775 30.756974 8.567903 26.885874 0.285022 28 In 6.715916 18.993636 8.225182 1.333767 156.450118 0.33315350E+04 0.12153774E+06 20.833651 16.460437 0.389344 1.822961 0.998817 81.134404 231.365033 0.550516 0.304979 -1.233460 0.107269 -0.075887 0.131375 0.185809 0.140144 -0.116036 0.115326 -0.155746 -0.314832 -0.266606 0.047165 0.219441 27.392402 30.245255 1.729019 -10.366993 25.048716 3.625181 26.883234 0.284998 29 In 4.476654 18.202025 20.561585 1.333776 156.460657 0.33317461E+04 0.12154780E+06 20.834889 16.461158 0.389253 1.822933 0.998816 81.135695 231.373607 0.550492 0.304986 -1.233448 -0.107295 -0.151760 0.000035 0.185859 -0.206223 -0.062796 0.044997 0.146063 0.287288 -0.266655 0.047427 0.219228 27.394492 24.540961 -5.809036 3.687357 20.433823 -2.605962 37.208693 0.285006 30 In 17.908119 13.454693 6.853862 1.333767 156.448052 0.33314864E+04 0.12153550E+06 20.833463 16.460312 0.389350 1.822965 0.998817 81.133947 231.363117 0.550518 0.304979 -1.233461 0.107276 0.151692 -0.000034 0.185792 -0.170543 -0.062806 0.044990 0.120597 0.514161 -0.266583 0.047153 0.219430 27.392124 30.244574 -9.842615 3.686525 23.285293 -2.606209 28.646506 0.284998 31 In -12.311696 8.706088 26.044126 1.333781 156.454582 0.33315994E+04 0.12154099E+06 20.834304 16.460753 0.389266 1.822942 0.998816 81.134459 231.367996 0.550501 0.304985 -1.233451 -0.107275 0.075895 -0.131387 0.185824 0.048706 -0.209957 0.116296 0.022537 -0.083290 -0.266596 0.047398 0.219198 27.393643 24.540247 6.097601 -3.187040 35.270740 5.960378 22.369941 0.284997 32 In 1.119769 -0.791586 15.079044 1.333771 156.445229 0.33314172E+04 0.12153231E+06 20.833210 16.460136 0.389352 1.822969 0.998817 81.133270 231.360331 0.550521 0.304978 -1.233461 0.107264 -0.075866 0.131338 0.185771 0.030868 -0.179079 0.159910 -0.078470 -0.083042 -0.266553 0.047139 0.219414 27.391754 30.244154 8.113729 -6.680651 29.562861 1.018300 22.368248 0.284990 33 In -1.119567 -11.079237 21.932906 1.333772 156.444393 0.33313981E+04 0.12153143E+06 20.833132 16.460085 0.389355 1.822971 0.998817 81.133101 231.359593 0.550523 0.304978 -1.233462 -0.107280 0.075822 0.131348 0.185769 0.157925 0.147372 -0.070934 -0.055020 -0.314785 -0.266547 0.047138 0.219409 27.391634 24.538722 -0.288292 6.873251 30.753705 -8.565400 26.882475 0.284991 34 In 12.312045 3.165510 19.190265 1.333782 156.452906 0.33315593E+04 0.12153914E+06 20.834155 16.460652 0.389271 1.822946 0.998816 81.134060 231.366363 0.550503 0.304984 -1.233452 0.107304 -0.075858 -0.131364 0.185809 0.140158 0.116475 -0.114670 -0.155839 -0.314543 -0.266577 0.047388 0.219189 27.393425 30.245693 1.729299 10.368459 25.050074 -3.624520 26.884507 0.284998 35 In 10.072617 2.373666 6.853862 1.333782 156.453830 0.33315816E+04 0.12154018E+06 20.834242 16.460711 0.389268 1.822944 0.998816 81.134260 231.367238 0.550502 0.304985 -1.233451 -0.107291 -0.151710 0.000035 0.185816 -0.206252 0.063354 -0.044206 0.145597 0.287187 -0.266587 0.047394 0.219193 27.393551 24.540542 -5.808670 -3.685872 20.432826 2.607715 37.207285 0.284996 36 In -10.072434 -2.373407 20.561585 1.333762 156.453530 0.33316185E+04 0.12154162E+06 20.833983 16.460672 0.389336 1.822955 0.998817 81.135092 231.368213 0.550510 0.304980 -1.233459 0.107280 0.151734 -0.000034 0.185829 -0.170583 0.063353 -0.044218 0.120611 0.514244 -0.266637 0.047180 0.219457 27.392878 30.245796 -9.842829 -3.686117 23.285541 2.607061 28.647296 0.285010 37 H 2.064080 13.598285 26.836981 0.131128 1.060093 0.74724979E+01 0.70984226E+02 1.618346 1.523286 -0.933655 2.444923 0.998855 3.167163 8.281592 0.553709 1.164470 -0.737457 -0.022232 0.007851 0.029189 0.037522 -0.011535 -0.012469 0.001385 0.000907 -0.001954 -0.016116 -0.001749 0.017865 1.672132 1.510414 -0.117255 -0.336501 1.406467 0.063973 2.099517 0.000163 38 H 4.792726 11.279433 25.068685 0.134042 1.213001 0.89830460E+01 0.89554689E+02 1.809487 1.705086 -0.942356 2.444728 0.998811 3.214573 8.674602 0.506222 1.213669 -0.728223 0.024916 -0.029585 -0.000102 0.038679 -0.012227 -0.007315 0.003104 0.003822 0.006385 -0.013859 -0.001767 0.015627 1.841214 1.786039 -0.442222 -0.003857 2.053778 -0.153089 1.683826 0.000547 39 H 4.624835 12.570999 23.204434 0.098449 1.212797 0.83804782E+01 0.82290415E+02 1.802015 1.632579 -0.996717 2.404866 0.997780 3.407315 9.191028 0.523016 1.192644 -0.729806 0.027383 -0.015815 -0.036004 0.047919 -0.016491 -0.012704 0.000885 -0.002319 0.002415 -0.020845 -0.000069 0.020914 1.932924 1.762125 -0.072042 -0.493367 1.503463 0.122779 2.533183 0.000176 40 H 1.976773 14.851863 24.912417 0.097559 1.248043 0.88787514E+01 0.88510512E+02 1.839391 1.683950 -1.062317 2.371883 0.997185 3.476386 9.469215 0.513009 1.197672 -0.728549 -0.034311 0.035303 0.001423 0.049251 -0.019191 -0.011228 -0.000251 0.004041 0.003693 -0.022583 0.000468 0.022115 1.931797 1.844848 -0.495852 0.118229 2.299835 -0.168433 1.650708 0.000281 41 H 4.989516 -1.989571 3.939600 0.107703 1.116778 0.78992473E+01 0.76216096E+02 1.680946 1.567536 -0.964843 2.414386 0.998433 3.338139 8.845676 0.544208 1.166488 -0.735891 0.027244 -0.012066 -0.021444 0.036711 -0.002437 -0.004542 0.011469 0.007222 0.018996 -0.013435 -0.001397 0.014832 1.749607 2.236200 -0.071017 -0.391068 1.347859 0.141352 1.664762 0.000043 42 H 18.438224 28.820078 4.046520 0.111841 1.089304 0.76339047E+01 0.73219950E+02 1.669109 1.552945 -0.967610 2.414447 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0.264304 0.182142 2.422023 0.416394 1.726028 0.000157 48 H 22.028672 26.604111 2.396110 0.110484 1.444566 0.10890662E+02 0.11391488E+03 2.025419 1.869040 -1.067252 2.369709 0.997087 3.510615 9.700393 0.486817 1.202857 -0.729932 0.022619 -0.016989 -0.019940 0.034610 -0.005744 -0.009344 0.014289 -0.010413 -0.003463 -0.014574 -0.006615 0.021190 2.083462 2.566480 -0.343020 -0.337884 1.906056 0.295080 1.777849 0.000001 49 H 0.940299 14.392744 14.286189 0.131132 1.060036 0.74719846E+01 0.70978632E+02 1.618317 1.523250 -0.933837 2.444834 0.998853 3.167298 8.282094 0.553703 1.164496 -0.737448 0.014807 -0.018348 -0.029185 0.037519 -0.009259 -0.005451 0.011309 0.013797 -0.001946 -0.016133 -0.001733 0.017866 1.672107 1.491691 -0.123879 -0.172495 1.425156 0.295937 2.099473 0.000162 50 H -2.155454 16.192430 16.054486 0.134037 1.216930 0.90201306E+01 0.90032113E+02 1.815232 1.710118 -0.942448 2.444693 0.998808 3.216552 8.689884 0.504721 1.215823 -0.727779 -0.036187 0.013622 0.000097 0.038666 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0.116816 1.454697 0.11083147E+02 0.11653332E+03 2.029662 1.880688 -1.295963 2.260806 0.995611 3.591842 9.977581 0.486763 1.196746 -0.730258 -0.014770 -0.000383 0.032355 0.035569 -0.015258 -0.012073 0.006545 0.007473 0.047250 -0.023742 -0.002224 0.025966 2.087317 1.711232 0.121961 -0.423978 2.100132 -0.370675 2.450588 0.000082 57 H -1.327255 24.704769 7.254127 0.117568 1.443914 0.10950484E+02 0.11463964E+03 2.021836 1.873102 -1.108321 2.353808 0.996860 3.488780 9.628321 0.486949 1.201492 -0.730508 0.021549 -0.018795 -0.022158 0.036174 -0.006271 -0.015072 0.003981 0.008303 0.024497 -0.013302 -0.008075 0.021378 2.062177 1.852111 -0.374970 -0.343403 2.339343 0.262627 1.995078 0.000023 58 H -4.805792 19.471998 11.651565 0.121981 1.274199 0.93597889E+01 0.94385063E+02 1.879339 1.746054 -0.918678 2.448527 0.998847 3.296541 8.981381 0.497266 1.221463 -0.726202 -0.034690 -0.013238 0.015512 0.040240 -0.001718 -0.011963 0.001465 0.012478 -0.036477 -0.017065 -0.000391 0.017455 1.932449 2.134344 0.337622 -0.391810 1.976898 -0.244614 1.686104 0.000342 59 H -1.302630 21.363450 9.417206 0.107036 1.466993 0.11348199E+02 0.11993581E+03 2.028243 1.891207 -1.305017 2.243653 0.995977 3.675150 10.209845 0.490345 1.181905 -0.733099 0.032796 0.007085 -0.007677 0.034419 -0.002367 -0.011063 0.014644 0.030044 -0.037424 -0.026398 0.000464 0.025934 2.075742 2.215815 0.310320 -0.331194 2.287192 -0.309922 1.724219 0.000156 60 H -4.644617 21.722769 11.311613 0.110495 1.441939 0.10867200E+02 0.11361043E+03 2.022826 1.866897 -1.067107 2.369780 0.997088 3.509954 9.696669 0.487137 1.202691 -0.729942 -0.023564 0.015675 0.019936 0.034618 -0.001214 -0.016550 0.004081 0.015356 -0.003586 -0.014567 -0.006606 0.021172 2.080694 2.191937 -0.473318 -0.389953 2.274421 0.219722 1.775723 0.000001 61 H -7.570322 14.038128 7.541989 0.131128 1.059805 0.74700002E+01 0.70954045E+02 1.617961 1.522958 -0.933713 2.444894 0.998856 3.167045 8.280707 0.553813 1.164359 -0.737480 0.027540 -0.011603 -0.022690 0.037522 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1.119117 0.78019650E+01 0.75025336E+02 1.682800 1.557237 -0.967885 2.414769 0.998520 3.312262 8.755041 0.546469 1.165566 -0.736226 0.019344 -0.031947 -0.009163 0.038454 -0.008938 -0.013163 0.004332 -0.008834 -0.003238 -0.016482 -0.001169 0.017651 1.769263 1.534166 -0.406464 -0.079843 2.346569 -0.022473 1.427056 0.000019 68 H -8.250772 6.413765 17.611683 0.116820 1.455564 0.11091238E+02 0.11664212E+03 2.030872 1.881719 -1.295915 2.260838 0.995612 3.591461 9.978220 0.486485 1.197184 -0.730176 -0.021329 0.025901 0.011830 0.035577 -0.019084 -0.012045 0.006570 0.010018 0.023211 -0.023772 -0.002207 0.025979 2.088588 1.813727 -0.354934 -0.190443 2.725272 -0.040249 1.726764 0.000081 69 H -5.934003 4.172466 15.347167 0.117570 1.442613 0.10937809E+02 0.11446252E+03 2.019592 1.871201 -1.108345 2.353801 0.996861 3.487916 9.620973 0.487563 1.200444 -0.730739 0.019776 -0.010421 -0.028447 0.036179 -0.011018 -0.010905 0.009920 -0.003720 0.009607 -0.013293 -0.008096 0.021389 2.059831 1.950920 -0.075388 -0.556515 1.863383 -0.040105 2.365192 0.000025 70 H -5.898160 11.839659 15.166225 0.121994 1.280444 0.94136435E+01 0.95037544E+02 1.883952 1.750027 -0.918781 2.448481 0.998846 3.296221 8.977395 0.497285 1.220009 -0.726624 0.005130 0.034138 0.020680 0.040242 0.004953 -0.005614 0.010501 -0.015725 0.029252 -0.017107 -0.000388 0.017496 1.937306 1.508200 0.170688 -0.038221 2.536050 0.256570 1.767667 0.000341 71 H -6.133225 7.637247 13.397929 0.107072 1.474580 0.11417665E+02 0.12083861E+03 2.034924 1.896859 -1.305676 2.243382 0.995971 3.676274 10.215789 0.489727 1.181746 -0.733218 -0.007993 -0.024587 -0.022667 0.034383 0.007248 -0.006556 0.021001 0.006711 0.040455 -0.026385 0.000461 0.025924 2.082801 1.586955 0.245348 -0.034587 2.708065 0.110474 1.953384 0.000158 72 H -6.735338 10.066908 16.334123 0.110479 1.452715 0.10964726E+02 0.11488823E+03 2.034312 1.876527 -1.067392 2.369650 0.997086 3.512721 9.715759 0.485384 1.204324 -0.729683 -0.015810 0.012172 0.028260 0.034594 -0.002967 -0.009050 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9.728326 8.017006 0.869070 0.110865 1.119126 0.78021232E+01 0.75028713E+02 1.682954 1.557362 -0.967909 2.414754 0.998519 3.312421 8.756132 0.546378 1.165730 -0.736186 0.016094 -0.033092 0.011158 0.038453 -0.011006 0.010834 -0.004488 -0.010562 0.008573 -0.016507 -0.001144 0.017651 1.769438 1.454926 -0.348038 0.081226 2.398094 -0.030071 1.455295 0.000018 104 H 7.731642 12.064277 0.016449 0.116799 1.452936 0.11068269E+02 0.11635053E+03 2.028826 1.880027 -1.296122 2.260740 0.995613 3.591906 9.980192 0.486561 1.197512 -0.730062 -0.014759 0.028235 -0.015853 0.035586 -0.002841 0.019280 -0.015110 -0.007463 0.002709 -0.023768 -0.002220 0.025988 2.086408 1.710582 -0.427805 0.106265 2.682625 0.033646 1.866016 0.000080 105 H 9.864888 9.758126 2.393369 0.117553 1.441687 0.10929131E+02 0.11434437E+03 2.018207 1.870037 -1.108451 2.353742 0.996860 3.487767 9.618135 0.487900 1.199903 -0.730851 0.021545 -0.009787 0.027381 0.036189 -0.009913 0.013021 -0.009096 -0.000547 -0.001887 -0.013343 -0.008073 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5.956679 21.662640 13.274559 0.111841 1.089304 0.76339048E+01 0.73219954E+02 1.669109 1.552945 -0.967610 2.414447 0.998503 3.338444 8.895645 0.539047 1.184669 -0.731144 0.016323 -0.022618 0.025294 0.037653 -0.009025 0.004964 -0.003628 -0.004281 0.041012 -0.016207 -0.000081 0.016289 1.742971 1.440006 -0.346488 0.144300 2.151896 -0.354471 1.637009 0.000104 115 H 16.072151 -2.518111 17.022251 0.110871 1.119492 0.78053311E+01 0.75068898E+02 1.683496 1.557825 -0.968064 2.414686 0.998518 3.312794 8.758281 0.546210 1.165944 -0.736136 0.019342 0.008030 0.032247 0.038451 -0.006934 0.014339 0.000479 -0.000574 0.021614 -0.016514 -0.001145 0.017659 1.770040 1.534792 0.134183 0.392205 1.677116 0.409678 2.098211 0.000019 116 H 14.133625 -3.782824 13.055236 0.116832 1.459452 0.11127341E+02 0.11711952E+03 2.035066 1.885284 -1.296173 2.260733 0.995610 3.592967 9.987298 0.485819 1.197825 -0.730062 -0.021321 -0.002710 -0.028323 0.035555 -0.000908 0.022558 -0.010474 0.003214 0.002917 -0.023773 -0.002214 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H 18.442675 2.766918 15.237505 0.107703 1.115069 0.78845951E+01 0.76040531E+02 1.679151 1.565985 -0.964687 2.414437 0.998434 3.337896 8.843465 0.544519 1.166345 -0.735903 0.014115 -0.016708 0.029492 0.036717 -0.004076 0.006838 -0.007928 0.017218 0.001705 -0.013396 -0.001426 0.014822 1.747666 1.529915 -0.046803 0.117153 1.451606 -0.404770 2.261479 0.000043 126 H 21.733154 6.242726 7.643427 0.111859 1.090755 0.76460104E+01 0.73364782E+02 1.670723 1.554295 -0.967694 2.414411 0.998502 3.338683 8.897890 0.538753 1.184850 -0.731120 -0.015429 0.021987 -0.026382 0.037650 -0.013376 0.002124 -0.007654 0.009228 0.002913 -0.016207 -0.000083 0.016290 1.744752 1.427565 -0.092003 0.002881 1.800502 -0.555429 2.006189 0.000103 127 H 15.508060 3.930270 12.838654 0.110870 1.118824 0.77995097E+01 0.74994936E+02 1.682378 1.556891 -0.968005 2.414713 0.998519 3.312146 8.754000 0.546589 1.165414 -0.736259 -0.036567 0.004143 -0.011153 0.038454 -0.005246 0.007855 -0.008700 0.022032 0.008548 -0.016484 -0.001169 0.017653 1.768793 2.511002 0.025714 0.055364 1.340559 -0.066501 1.454820 0.000019 128 H 19.989433 3.396867 13.691274 0.116816 1.454699 0.11083157E+02 0.11653346E+03 2.029663 1.880689 -1.295964 2.260805 0.995611 3.591844 9.977589 0.486762 1.196746 -0.730258 0.031522 -0.004521 0.015846 0.035569 0.000121 0.020672 -0.013110 0.009294 0.002690 -0.023742 -0.002224 0.025966 2.087319 2.845020 -0.027309 0.003781 1.550203 -0.111478 1.866734 0.000082 129 H 17.104065 4.639361 11.314355 0.117568 1.443922 0.10950555E+02 0.11464062E+03 2.021848 1.873112 -1.108321 2.353808 0.996860 3.488784 9.628356 0.486946 1.201497 -0.730507 -0.016415 0.017052 -0.027356 0.036174 -0.007541 0.012894 -0.009194 0.012894 -0.002060 -0.013302 -0.008075 0.021377 2.062190 1.922622 -0.084991 0.148741 1.783212 -0.473965 2.480735 0.000024 130 H 24.320797 3.501289 8.981300 0.121981 1.274211 0.93599029E+01 0.94386589E+02 1.879359 1.746071 -0.918678 2.448527 0.998847 3.296553 8.981459 0.497260 1.221473 -0.726200 0.030469 -0.026022 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-0.933837 2.444834 0.998853 3.167297 8.282093 0.553702 1.164496 -0.737447 -0.022234 -0.029198 -0.007799 0.037519 0.016576 -0.003753 -0.000910 0.000111 -0.004337 -0.016133 -0.001733 0.017866 1.672106 1.510411 0.350057 0.066701 1.981631 0.268096 1.524277 0.000163 134 H 15.984868 -11.521136 24.649228 0.134037 1.216940 0.90202318E+01 0.90033428E+02 1.815247 1.710131 -0.942449 2.444693 0.998808 3.216562 8.689942 0.504716 1.215829 -0.727777 0.024905 0.014872 -0.025566 0.038666 0.012426 -0.006865 0.000720 -0.002716 -0.013125 -0.013832 -0.001730 0.015562 1.847208 1.791696 0.225610 -0.382996 1.648703 -0.084005 2.101226 0.000551 135 H 15.817002 -10.552429 26.699904 0.098435 1.212874 0.83813340E+01 0.82300467E+02 1.802017 1.632615 -0.996861 2.404779 0.997778 3.407521 9.191511 0.523036 1.192575 -0.729820 0.027401 0.039081 0.004305 0.047923 0.019268 -0.007923 -0.000413 -0.003122 0.000058 -0.020871 -0.000050 0.020921 1.932902 1.762092 0.463247 0.184315 2.381990 0.384537 1.654625 0.000176 136 H 24.361028 2.655981 0.405749 0.097572 1.247959 0.88781297E+01 0.88503743E+02 1.839407 1.683969 -1.062178 2.371959 0.997187 3.476286 9.469254 0.512965 1.197783 -0.728524 -0.034310 -0.018879 0.029863 0.049248 0.019328 -0.010998 0.001804 0.001371 -0.004316 -0.022591 0.000477 0.022114 1.931816 1.844889 0.145525 -0.488531 1.667147 -0.196841 2.283412 0.000281 137 H -17.394758 13.411483 23.722586 0.107703 1.115068 0.78845835E+01 0.76040384E+02 1.679149 1.565984 -0.964684 2.414439 0.998434 3.337892 8.843450 0.544520 1.166345 -0.735903 0.027251 0.024605 0.000276 0.036717 0.005168 0.000162 -0.000060 -0.012539 -0.040182 -0.013396 -0.001426 0.014822 1.747665 2.233338 0.373554 0.133795 1.706127 0.066440 1.303529 0.000043 138 H 7.246058 13.742285 22.935763 0.111859 1.090757 0.76460219E+01 0.73364913E+02 1.670723 1.554296 -0.967695 2.414411 0.998502 3.338685 8.897894 0.538754 1.184849 -0.731120 -0.026763 -0.025827 0.005851 0.037650 0.007246 0.002377 -0.010320 -0.009200 -0.030632 -0.016207 -0.000083 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-0.000389 0.017496 1.937276 2.314524 0.455766 0.254631 1.729662 0.049487 1.767641 0.000340 227 H 14.841101 4.677497 27.105652 0.107072 1.474579 0.11417664E+02 0.12083858E+03 2.034923 1.896859 -1.305675 2.243383 0.995971 3.676272 10.215781 0.489727 1.181746 -0.733218 -0.020516 -0.015731 -0.022667 0.034383 0.003529 0.021985 0.000819 -0.014331 0.040455 -0.026385 0.000461 0.025924 2.082801 2.429290 0.543154 0.115686 1.865728 0.004216 1.953384 0.000157 228 H -5.052076 20.747668 2.626400 0.110479 1.452716 0.10964740E+02 0.11488840E+03 2.034313 1.876528 -1.067393 2.369650 0.997086 3.512722 9.715762 0.485384 1.204324 -0.729683 0.016746 -0.010849 0.028260 0.034594 0.001187 0.016936 -0.003611 0.012376 0.012614 -0.014628 -0.006555 0.021183 2.092906 1.837019 0.027274 0.252350 1.758328 -0.421545 2.683372 0.000001 229 H -14.724270 16.442602 25.194796 0.131128 1.060092 0.74724818E+01 0.70984018E+02 1.618342 1.523282 -0.933651 2.444925 0.998855 3.167160 8.281574 0.553711 1.164467 -0.737457 -0.022232 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H 20.249035 6.399384 3.314528 0.110871 1.119491 0.78053237E+01 0.75068803E+02 1.683495 1.557824 -0.968063 2.414687 0.998518 3.312792 8.758272 0.546211 1.165943 -0.736136 0.001124 0.020912 0.032247 0.038451 -0.005213 -0.004328 0.013679 0.009163 0.021614 -0.016514 -0.001145 0.017659 1.770038 1.576962 0.149093 0.255513 1.634943 0.506332 2.098209 0.000019 236 H 8.510708 -11.677815 26.762959 0.116832 1.459448 0.11127300E+02 0.11711897E+03 2.035062 1.885281 -1.296175 2.260733 0.995610 3.592960 9.987272 0.485820 1.197825 -0.730062 0.004552 -0.021005 -0.028323 0.035555 -0.001716 -0.017394 0.017777 -0.001358 0.002916 -0.023773 -0.002214 0.025987 2.093049 1.985618 0.072075 0.293388 1.847184 0.532139 2.446346 0.000082 237 H 18.138173 6.054321 2.420784 0.117555 1.442721 0.10939747E+02 0.11449981E+03 2.020591 1.872058 -1.108449 2.353746 0.996859 3.488767 9.627313 0.487131 1.201331 -0.730528 -0.024905 0.012174 0.023252 0.036181 -0.003885 -0.010860 0.012081 0.002842 0.028801 -0.013305 -0.008091 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15.429751 -1.171088 21.351150 0.111859 1.090757 0.76460212E+01 0.73364914E+02 1.670724 1.554296 -0.967695 2.414411 0.998502 3.338685 8.897898 0.538753 1.184850 -0.731120 0.025873 -0.007218 -0.026382 0.037650 -0.013304 -0.007924 -0.000549 0.009637 0.002913 -0.016207 -0.000083 0.016289 1.744753 1.816893 0.045644 -0.524626 1.411176 -0.182425 2.006191 0.000103 247 H 15.324553 -7.810981 26.546377 0.110870 1.118824 0.77995091E+01 0.74994932E+02 1.682378 1.556891 -0.968006 2.414713 0.998519 3.312146 8.754001 0.546589 1.165414 -0.736259 0.016095 -0.033094 -0.011153 0.038454 -0.011004 -0.010821 0.004505 -0.010542 0.008548 -0.016484 -0.001169 0.017653 1.768793 1.454443 -0.347832 -0.081153 2.397117 0.030031 1.454820 0.000019 248 H 24.519991 12.064276 -0.016449 0.116816 1.454698 0.11083148E+02 0.11653334E+03 2.029662 1.880689 -1.295963 2.260806 0.995611 3.591843 9.977585 0.486763 1.196746 -0.730258 -0.014770 0.028212 0.015846 0.035569 -0.002827 -0.019251 0.015120 -0.007380 0.002690 -0.023742 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26.911167 74.339013 0.651959 0.406134 -1.081353 0.047566 0.015527 0.007264 0.050561 -0.001670 -0.002546 -0.005264 -0.004560 -0.009372 -0.007342 0.000661 0.006681 14.120407 25.521838 4.385469 2.558585 9.990794 2.736238 6.848589 0.004904 329 C 3.420569 12.285802 26.176269 0.026556 37.701072 0.40100327E+03 0.91485147E+04 9.762705 6.623889 0.033853 2.027183 0.999313 26.061022 71.468219 0.654326 0.410308 -1.078711 -0.004287 0.022650 -0.039649 0.045863 0.013991 0.001771 0.024250 0.004755 -0.044062 -0.032064 0.002493 0.029571 13.661991 7.161821 -2.213814 -0.897593 12.321650 -7.706484 21.502502 0.018067 330 C 5.813955 -0.660297 6.050041 0.624087 25.208842 0.24003562E+03 0.49137214E+04 7.918223 5.476225 0.034831 2.072128 0.999526 21.837561 60.540695 0.638636 0.468509 -1.022946 0.062579 0.022460 0.017516 0.068756 -0.027481 -0.009092 -0.049596 -0.161246 -0.056567 -0.081589 -0.030422 0.112011 10.369957 14.787229 2.221101 1.598255 5.713289 2.607932 10.609352 0.001301 331 C 4.114699 12.790702 23.950683 0.087431 28.000354 0.31777393E+03 0.69180724E+04 8.062702 5.974644 0.202687 2.081567 0.999803 25.708173 71.466245 0.667886 0.421247 -1.059563 -0.038397 0.035998 0.015697 0.054923 0.007781 -0.006806 0.037113 0.032593 -0.050968 -0.051176 0.024152 0.027024 9.876764 6.579619 -1.853801 -1.300956 8.871361 -3.509912 14.179314 0.005283 332 C 14.709162 27.296257 0.006306 0.615778 24.098841 0.23655132E+03 0.48224273E+04 7.692092 5.427558 0.099723 2.101838 0.999630 21.635158 59.762689 0.643355 0.466998 -1.024261 0.000087 -0.040810 0.058936 0.071686 0.055503 0.014102 0.018108 0.124399 -0.188798 -0.072024 -0.044956 0.116981 10.135280 5.020906 -1.624999 -0.302778 10.541523 -4.036093 14.843410 0.010588 333 C 2.557423 14.128830 24.953540 0.081276 28.901956 0.33292439E+03 0.73318934E+04 8.234861 6.119284 0.171881 2.066469 0.999743 26.069509 72.860284 0.659400 0.421781 -1.059357 0.035476 -0.029920 -0.031115 0.055874 -0.005615 0.004726 0.028171 0.021858 -0.096278 -0.047871 0.019389 0.028482 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9.356739 6.807450 0.079313 1.996162 0.999666 28.948580 82.712959 0.629630 0.418628 -1.062898 -0.015480 -0.017904 -0.018234 0.029877 -0.005254 -0.004237 0.014944 -0.026325 0.050116 -0.022583 -0.005107 0.027691 11.847921 18.363618 3.128449 2.899803 6.864538 3.057238 10.315607 0.000639 340 C 3.017445 -2.171595 4.062969 -0.159479 35.690746 0.41214821E+03 0.96243117E+04 9.568917 6.843696 -0.014578 1.969076 0.999517 29.801636 87.243259 0.615504 0.426147 -1.051128 0.026652 0.006725 0.009585 0.029111 -0.024126 -0.002841 -0.007623 -0.030287 0.076303 -0.041774 0.013541 0.028233 12.381726 20.684350 3.835705 2.206210 7.007599 2.649628 9.453230 0.002249 341 C 2.097460 -1.169650 5.951894 -0.163727 37.005649 0.41613710E+03 0.97352888E+04 9.772931 6.849278 -0.026149 1.960493 0.999666 29.972356 87.658774 0.619312 0.422751 -1.053838 0.031442 0.012856 0.016631 0.037822 -0.024397 -0.028070 -0.013945 -0.037038 0.002025 -0.050256 0.019964 0.030292 12.672609 18.387260 4.167880 4.409160 8.246202 4.285535 11.384364 0.001536 342 C 20.058840 26.510725 2.503030 -0.102734 34.007470 0.39965345E+03 0.92099553E+04 9.144118 6.647071 0.061443 1.993513 0.999711 28.839276 82.369415 0.641097 0.414580 -1.064249 0.012454 0.014928 0.018163 0.026605 -0.005148 -0.007472 0.011791 -0.038625 -0.007308 -0.021092 -0.005737 0.026829 11.569573 19.047046 2.882182 1.336560 9.462119 2.448993 6.199553 0.001451 343 C 20.450586 28.812163 3.879286 -0.157680 36.031591 0.40997157E+03 0.95706113E+04 9.685487 6.846525 -0.046392 1.958870 0.999613 29.834373 87.618496 0.611931 0.428764 -1.048447 -0.030432 -0.008257 -0.015496 0.035134 -0.002271 -0.017565 -0.017036 -0.062209 0.049744 -0.045190 0.006909 0.038281 12.974536 23.329920 3.295893 2.279192 9.327164 2.128290 6.266525 0.002126 344 C 21.292228 27.034642 2.763477 -0.153308 36.221495 0.39912894E+03 0.92491365E+04 9.660993 6.723008 0.000389 1.974072 0.999673 29.570023 86.335886 0.622405 0.424664 -1.051665 -0.037238 -0.007926 -0.010703 0.039548 -0.031323 -0.024650 -0.016515 -0.030491 0.063520 -0.056716 0.024160 0.032556 12.454660 18.603366 4.722241 2.549039 11.051987 3.953019 7.708627 0.001292 345 C 0.547906 14.819796 15.014344 -0.155337 33.596386 0.40877474E+03 0.94418036E+04 8.987724 6.706866 0.167327 2.027019 0.999715 28.861046 81.629177 0.642612 0.412654 -1.069059 -0.014666 0.005407 0.003608 0.016042 -0.004490 -0.018979 0.008848 -0.029530 -0.008150 -0.027854 0.003911 0.023943 11.095847 12.013274 -0.617110 4.890521 5.674474 1.957145 15.599794 0.003719 346 C -1.278880 15.882197 16.064904 -0.149338 33.346380 0.39895233E+03 0.91623291E+04 8.924804 6.598184 0.187966 2.038098 0.999725 28.631805 80.843384 0.651722 0.409222 -1.070912 0.009933 -0.009393 -0.014057 0.019609 -0.008751 -0.013357 -0.008637 0.013207 -0.056446 -0.027429 0.005087 0.022342 11.105881 10.094536 -0.392706 3.861097 6.154946 3.233190 17.068160 0.004725 347 C -2.997362 17.563108 11.066519 0.628173 24.124602 0.23922426E+03 0.48976473E+04 7.736525 5.477030 0.050913 2.080826 0.999566 21.816771 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-5.624960 11.579711 0.000639 380 C -7.856810 5.593861 17.425258 -0.159446 35.690140 0.41219056E+03 0.96252946E+04 9.568546 6.844095 -0.014321 1.969153 0.999516 29.799909 87.230683 0.615495 0.426153 -1.051152 -0.004261 -0.022572 0.017908 0.029127 -0.023565 0.014680 0.017125 0.033705 0.015509 -0.041878 0.013670 0.028207 12.380982 8.122203 1.556731 -4.238666 16.511410 -6.465774 12.509333 0.002250 381 C -6.480179 4.269025 16.095609 -0.163782 36.997317 0.41605352E+03 0.97325792E+04 9.770467 6.847968 -0.026193 1.960480 0.999667 29.970708 87.642745 0.619472 0.422674 -1.053915 -0.002927 -0.033049 0.018270 0.037876 0.000949 0.002688 0.029625 0.058319 0.049950 -0.050546 0.020003 0.030543 12.669160 7.073951 -0.048023 -2.641975 19.859165 -5.686273 11.074365 0.001536 382 C -5.947411 10.996010 14.779667 -0.102750 33.992607 0.39936718E+03 0.92022166E+04 9.141210 6.643628 0.061365 1.993490 0.999710 28.840974 82.383977 0.641382 0.414447 -1.064275 0.003662 -0.026293 0.001545 0.026592 0.000849 0.001016 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0.628162 24.124761 0.23923191E+03 0.48977636E+04 7.736212 5.476884 0.050958 2.080839 0.999567 21.816365 60.670893 0.636280 0.470196 -1.021068 -0.068763 -0.002636 0.026836 0.073861 -0.009856 0.016568 -0.003009 -0.185118 -0.116209 -0.080201 -0.032350 0.112551 10.111555 16.389675 0.090076 -2.413084 4.453877 0.474600 9.491113 0.006649 408 C 30.139823 4.753240 2.358825 -0.030616 39.223974 0.42365713E+03 0.98000897E+04 10.006349 6.773704 0.035002 2.016882 0.999342 26.911180 74.338124 0.651961 0.406134 -1.081357 0.047597 -0.001482 -0.017102 0.050598 -0.001386 0.002810 0.005739 -0.003965 -0.007486 -0.007488 0.000694 0.006794 14.119043 25.517172 0.022710 -5.072209 5.263923 -0.007288 11.576034 0.004904 409 C 25.804841 0.698218 3.687652 0.026613 37.702246 0.40101633E+03 0.91488821E+04 9.763006 6.623995 0.033836 2.027186 0.999313 26.060745 71.467603 0.654321 0.410307 -1.078712 -0.004258 -0.045668 0.000216 0.045866 -0.005477 -0.012918 -0.003553 0.040490 0.063130 -0.032046 0.002559 0.029487 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-3.114035 14.499305 0.000837 418 C 30.353362 4.833951 1.014372 -0.095921 34.561719 0.40441562E+03 0.93467875E+04 9.288050 6.724328 0.059103 1.992043 0.999657 28.823162 82.427076 0.632078 0.419277 -1.061318 0.028630 0.004581 0.005683 0.029546 -0.004416 0.022372 0.000132 -0.006547 0.009791 -0.024037 0.001750 0.022286 11.997309 20.360417 -0.187406 -4.010366 4.961380 -0.013746 10.670131 0.000563 419 C -7.834435 -9.906654 24.895967 -0.098241 35.070146 0.41509482E+03 0.96454941E+04 9.355661 6.806946 0.079327 1.996170 0.999665 28.946144 82.698782 0.629710 0.418590 -1.062945 -0.015479 -0.006830 0.024637 0.029887 -0.001074 0.006801 -0.012411 -0.022364 0.062235 -0.022658 -0.004925 0.027583 11.846429 18.361559 0.946949 -4.159008 6.804242 -3.022236 10.373487 0.000638 420 C -8.174668 -11.223540 27.264662 -0.159446 35.690145 0.41219036E+03 0.96252888E+04 9.568547 6.844093 -0.014320 1.969153 0.999516 29.799906 87.230671 0.615496 0.426153 -1.051152 0.026683 0.004914 -0.010594 0.029127 0.009599 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21.799799 5.628665 -0.149314 33.348796 0.39901954E+03 0.91635159E+04 8.925541 6.599900 0.188236 2.038193 0.999724 28.627021 80.806915 0.651518 0.409366 -1.070905 0.009890 -0.007474 0.015152 0.019577 -0.007202 0.014451 0.013887 0.022062 -0.030396 -0.027739 0.005200 0.022539 11.107182 10.088416 3.539224 -1.593115 11.544664 -6.346581 11.688467 0.004718 427 C 8.194838 16.630625 6.672097 0.628224 24.124901 0.23922520E+03 0.48977249E+04 7.736809 5.477204 0.050867 2.080812 0.999568 21.817070 60.678846 0.636175 0.470264 -1.021003 0.002257 0.049667 0.054610 0.073852 0.039973 -0.039759 -0.082676 -0.013348 -0.006329 -0.080055 -0.032465 0.112521 10.112600 8.218583 -0.793866 1.433806 9.791462 5.915393 12.327755 0.006648 428 C 8.171323 15.641509 5.550531 -0.030619 39.227535 0.42369136E+03 0.98012233E+04 10.007319 6.774191 0.034947 2.016860 0.999343 26.912600 74.346905 0.651897 0.406159 -1.081324 -0.001193 -0.031357 -0.039719 0.050619 0.003591 -0.002124 -0.001274 0.010750 0.005873 -0.007483 0.000776 0.006707 14.121309 8.963076 -0.761018 2.138309 14.653045 10.193178 18.747805 0.004904 429 C 10.442928 21.155600 6.748861 0.026629 37.699521 0.40098137E+03 0.91478621E+04 9.762507 6.623679 0.033892 2.027210 0.999313 26.059865 71.463729 0.654342 0.410304 -1.078717 0.022775 0.032574 -0.022894 0.045868 -0.023950 0.003034 0.019040 -0.005137 0.004311 -0.032079 0.002561 0.029518 13.662221 13.139921 6.084916 -3.397989 14.756246 -8.271710 13.090496 0.018064 430 C -2.560416 -7.869868 25.884020 0.623946 25.210590 0.24006298E+03 0.49143350E+04 7.917917 5.476102 0.034584 2.072018 0.999527 21.838958 60.541416 0.638730 0.468435 -1.023005 0.000348 -0.048433 -0.048779 0.068740 0.023320 -0.047224 -0.034873 0.143062 -0.107406 -0.081538 -0.030517 0.112055 10.369417 5.325143 -1.105717 1.936442 13.807798 3.164841 11.975310 0.001300 431 C 10.687584 22.671611 4.923540 0.087463 27.996570 0.31773315E+03 0.69169581E+04 8.061738 5.974202 0.202913 2.081646 0.999803 25.706874 71.461313 0.667921 0.421239 -1.059569 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0.94224455E+04 9.832981 6.672206 0.009003 2.011928 0.999351 26.738863 73.840989 0.655246 0.406962 -1.079733 0.000780 0.037432 0.028506 0.047057 0.004253 -0.003465 -0.005142 0.011370 0.011036 -0.010112 0.000331 0.009780 13.458072 6.323799 -1.119830 2.029767 18.408016 7.797862 15.642400 0.002789 435 C 8.139069 13.789586 3.481762 0.199997 38.304165 0.34091079E+03 0.75954989E+04 10.335036 6.383426 -0.374506 1.903936 0.999040 25.513062 73.066004 0.613327 0.448227 -1.037453 0.002487 -0.025926 -0.020668 0.033249 0.015864 -0.041375 -0.009494 -0.027757 0.009284 -0.049279 0.003852 0.045428 15.723448 9.146403 -2.517198 0.407401 19.966310 12.365213 18.057629 0.002093 436 C -3.086661 -5.580782 26.686196 -0.086785 34.130069 0.38876338E+03 0.89051448E+04 9.201252 6.597157 0.044117 1.990216 0.999623 28.572159 81.594489 0.636929 0.419817 -1.059983 0.004816 0.001448 0.031934 0.032328 0.001849 0.008958 -0.018738 0.037398 0.019413 -0.031932 0.008816 0.023116 11.774138 5.950673 -1.367381 1.612933 15.787459 6.023957 13.584282 -0.000014 437 C 8.770286 11.044952 1.381739 0.191003 39.955155 0.37209433E+03 0.84543150E+04 10.612620 6.656603 -0.368697 1.898379 0.998940 26.004853 74.647906 0.603667 0.446564 -1.040795 -0.007531 0.024685 0.016313 0.030532 0.023036 -0.026208 0.014572 -0.011760 -0.064143 -0.047304 0.012291 0.035013 16.157110 7.031469 -2.555103 0.687229 22.205671 11.239023 19.234191 0.000836 438 C 9.159817 14.710808 5.422775 -0.095972 34.564019 0.40447313E+03 0.93485734E+04 9.288839 6.725035 0.058964 1.991993 0.999656 28.825216 82.438542 0.632004 0.419306 -1.061286 -0.016355 -0.013267 -0.020773 0.029580 0.000638 0.012269 -0.014107 0.027000 0.004925 -0.023902 0.001669 0.022233 11.998496 8.226465 -1.129655 1.488704 12.363379 7.762762 15.405646 0.000562 439 C 9.338838 8.843238 0.677162 -0.098267 35.070746 0.41510483E+03 0.96459259E+04 9.356152 6.807296 0.079370 1.996179 0.999666 28.947551 82.707609 0.629647 0.418623 -1.062909 -0.011717 0.026065 0.008671 0.029864 -0.015445 0.004205 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10.925878 -0.155358 33.598635 0.40881341E+03 0.94428732E+04 8.987975 6.707167 0.167198 2.026971 0.999715 28.861222 81.629115 0.642603 0.412652 -1.069066 -0.000544 0.010399 -0.012213 0.016050 -0.022786 0.012028 0.001868 -0.007047 0.008106 -0.027993 0.004119 0.023873 11.096140 16.971445 4.657537 0.178456 8.784255 -2.321437 7.532719 0.003720 446 C 2.207236 17.114677 9.215703 -0.149248 33.349421 0.39902242E+03 0.91640123E+04 8.925733 6.599450 0.188328 2.038240 0.999724 28.628338 80.824446 0.651581 0.409307 -1.070895 0.012630 -0.008454 0.012444 0.019643 -0.004267 -0.001441 -0.008540 -0.038383 0.046872 -0.027607 0.005259 0.022348 11.107305 18.341300 3.310650 1.643596 7.742356 -1.769263 7.238259 0.004724 447 C 6.068805 20.768480 10.797025 0.628153 24.126238 0.23923785E+03 0.48978905E+04 7.736556 5.476903 0.050897 2.080815 0.999567 21.816293 60.669705 0.636291 0.470188 -1.021078 0.020418 -0.065746 -0.026841 0.073891 0.050546 0.008486 -0.014456 0.156395 -0.116175 -0.080150 -0.032433 0.112583 10.112402 5.723679 -3.681164 -1.252131 15.121301 2.118505 9.492226 0.006647 448 C 5.627169 22.086502 11.348898 -0.030588 39.223681 0.42365533E+03 0.98000716E+04 10.006370 6.773690 0.034940 2.016864 0.999344 26.911170 74.339026 0.651959 0.406134 -1.081353 -0.017244 0.044355 0.017079 0.050561 0.000159 -0.004419 -0.004446 0.004750 -0.007374 -0.007342 0.000661 0.006681 14.120421 7.500736 -6.348245 -1.685260 23.285638 4.789387 11.574888 0.004904 449 C 3.249013 16.647751 10.020072 0.026556 37.701097 0.40100360E+03 0.91485239E+04 9.762707 6.623890 0.033853 2.027183 0.999313 26.061038 71.468264 0.654326 0.410307 -1.078711 -0.041622 -0.019262 -0.000208 0.045864 -0.016974 -0.000925 0.013463 -0.024631 0.063162 -0.032064 0.002494 0.029570 13.661994 23.594281 6.139232 0.903698 9.448854 -2.190035 7.942848 0.018067 450 C 14.505464 -0.575995 16.160858 0.624088 25.208816 0.24003550E+03 0.49137187E+04 7.918218 5.476225 0.034831 2.072128 0.999526 21.837561 60.540701 0.638635 0.468509 -1.022946 -0.017145 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6.119286 0.171881 2.066469 0.999743 26.069518 72.860308 0.659400 0.421781 -1.059357 -0.023127 0.029452 -0.041469 0.055875 -0.017939 -0.001077 -0.003033 -0.066357 0.060635 -0.047871 0.019389 0.028482 10.100717 14.888146 3.310736 0.622541 8.063120 -2.215315 7.350885 0.006669 454 C 14.779889 -1.914436 15.585682 -0.031961 38.335913 0.41021901E+03 0.94223829E+04 9.833077 6.672046 0.009282 2.012008 0.999351 26.738759 73.839123 0.655281 0.406943 -1.079752 0.005380 -0.041808 -0.020967 0.047079 0.000526 -0.003760 -0.005594 0.012933 -0.011669 -0.010083 0.000285 0.009798 13.458236 7.762113 -3.605571 1.182036 21.204394 6.598493 11.408201 0.002790 455 C 16.013903 -7.125752 12.391782 0.200006 38.307172 0.34093730E+03 0.75964402E+04 10.336327 6.384350 -0.374552 1.903922 0.999040 25.514459 73.078074 0.613169 0.448322 -1.037370 -0.005452 0.027995 0.016973 0.033189 0.017623 -0.018564 0.022803 0.054750 -0.063130 -0.049354 0.003945 0.045409 15.725034 6.960949 -5.363970 -2.128152 25.088340 8.779385 15.125813 0.002094 456 C 14.256754 -2.317117 14.409559 -0.086770 34.131613 0.38876404E+03 0.89050280E+04 9.201311 6.596945 0.044286 1.990277 0.999623 28.570481 81.585033 0.636980 0.419789 -1.060017 0.023807 -0.021683 0.003098 0.032350 -0.003192 0.004306 -0.025265 0.024039 0.004260 -0.031892 0.008859 0.023033 11.774472 7.279821 -3.063302 1.176011 17.523158 5.408217 10.520437 -0.000013 457 C 15.382686 -4.381117 14.491805 0.191062 39.949348 0.37205709E+03 0.84531198E+04 10.610974 6.655930 -0.368578 1.898429 0.998941 26.003038 74.637183 0.603753 0.446518 -1.040839 0.004184 -0.022306 -0.020443 0.030545 0.027396 -0.025566 0.015495 -0.012436 -0.038751 -0.047319 0.012312 0.035007 16.152830 8.708936 -5.308517 -0.215964 25.253354 9.953312 14.496200 0.000837 458 C 5.632103 22.314758 12.693352 -0.095938 34.560051 0.40442297E+03 0.93470455E+04 9.287863 6.724542 0.059132 1.992048 0.999657 28.823731 82.430405 0.632043 0.419296 -1.061301 -0.005214 0.028512 -0.005677 0.029535 -0.001405 0.007449 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11.086807 -0.153308 36.221533 0.39912940E+03 0.92491496E+04 9.660999 6.723011 0.000388 1.974072 0.999673 29.570026 86.335897 0.622405 0.424664 -1.051665 0.007410 -0.036877 -0.012215 0.039548 0.013547 0.012107 -0.037564 0.051621 -0.016543 -0.056716 0.024160 0.032556 12.454667 6.715570 -4.356462 -1.289388 17.008880 5.233616 13.639551 0.001292 465 C -6.101698 10.294901 6.633716 -0.155337 33.596392 0.40877475E+03 0.94418039E+04 8.987726 6.706867 0.167327 2.027019 0.999715 28.861047 81.629182 0.642612 0.412654 -1.069059 0.005285 -0.013686 0.006487 0.016041 -0.008607 0.000939 -0.013857 0.023858 0.057228 -0.027854 0.003911 0.023943 11.095852 8.633152 3.348852 4.337669 14.803767 3.560269 9.850637 0.003719 466 C -5.135804 8.698796 8.079058 -0.149338 33.346379 0.39895193E+03 0.91623187E+04 8.924800 6.598175 0.187966 2.038098 0.999725 28.631811 80.843427 0.651723 0.409221 -1.070913 -0.010361 0.006872 -0.015163 0.019609 -0.012489 -0.008145 -0.018001 -0.008026 -0.030241 -0.027429 0.005087 0.022342 11.105879 9.154222 3.207729 5.449309 12.480274 3.613490 11.683142 0.004725 467 C 24.140148 5.355548 7.035626 0.628174 24.124529 0.23922353E+03 0.48976289E+04 7.736508 5.477021 0.050919 2.080828 0.999566 21.816752 60.675421 0.636221 0.470236 -1.021029 0.046097 0.018703 -0.054634 0.073890 0.035301 0.064790 0.065186 -0.039839 -0.006247 -0.080177 -0.032519 0.112696 10.112264 10.116180 -0.123313 -5.099338 7.893525 -3.322854 12.327089 0.006650 468 C 23.215452 5.003697 8.157192 -0.030584 39.222410 0.42364222E+03 0.97997649E+04 10.006354 6.773702 0.034938 2.016861 0.999343 26.911328 74.341239 0.651937 0.406148 -1.081336 -0.029154 -0.011575 0.039705 0.050601 -0.000592 0.000537 0.002532 -0.012869 0.005879 -0.007489 0.000700 0.006789 14.120339 14.499072 1.196809 -8.898071 9.115168 -5.412531 18.746778 0.004904 469 C -5.919715 8.983377 6.958863 0.026627 37.704160 0.40103570E+03 0.91495501E+04 9.763747 6.624527 0.033819 2.027180 0.999313 26.061321 71.473017 0.654231 0.410353 -1.078668 0.023124 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7.692225 5.427762 0.099665 2.101824 0.999630 21.636059 59.768576 0.643302 0.467028 -1.024229 -0.028916 -0.051072 -0.041187 0.071699 0.005842 -0.080706 -0.031317 0.054753 0.161020 -0.071923 -0.045025 0.116948 10.135396 9.014072 2.288351 4.192448 12.808720 3.879294 8.583397 0.010586 473 C -5.502456 11.279108 7.397510 0.081204 28.906202 0.33298146E+03 0.73336134E+04 8.236360 6.120308 0.171786 2.066420 0.999743 26.071853 72.873971 0.659250 0.421850 -1.059292 0.027678 -0.032655 0.035885 0.055858 -0.018067 -0.020737 -0.030898 0.006036 -0.012400 -0.047771 0.019251 0.028521 10.102691 8.022143 2.397304 3.954731 12.792597 2.496550 9.493332 0.006668 474 C 16.827183 3.307601 14.242325 -0.031942 38.332310 0.41017981E+03 0.94212435E+04 9.832403 6.671695 0.009249 2.011998 0.999352 26.738072 73.835935 0.655304 0.406939 -1.079756 0.035018 0.013227 -0.028538 0.047071 -0.000272 0.003795 0.005081 -0.014261 0.011078 -0.010214 0.000299 0.009916 13.457534 17.767844 2.926774 -6.675838 6.962306 -4.512831 15.642452 0.002790 475 C 21.480219 4.356025 10.225962 0.199982 38.312300 0.34094907E+03 0.75970098E+04 10.338587 6.385130 -0.374543 1.903930 0.999039 25.515948 73.091411 0.613016 0.448416 -1.037283 -0.025271 -0.006298 0.020624 0.033221 0.021060 -0.004786 0.042278 0.001684 0.009278 -0.049351 0.003816 0.045535 15.730377 20.354252 1.445407 -11.529649 8.769005 -4.508411 18.067874 0.002093 476 C 18.151673 3.143623 14.436974 -0.086772 34.138938 0.38889837E+03 0.89087553E+04 9.202501 6.598206 0.044267 1.990265 0.999623 28.570672 81.584993 0.636910 0.419804 -1.060021 -0.000245 0.005007 -0.031970 0.032361 -0.010338 0.020773 -0.001987 -0.031485 0.019319 -0.032091 0.009052 0.023038 11.775970 15.558113 2.028685 -5.144058 6.184804 -3.528425 13.584992 -0.000013 477 C 18.682174 4.036315 12.325985 0.191087 39.953254 0.37207443E+03 0.84539020E+04 10.613220 6.657038 -0.368676 1.898390 0.998943 26.004798 74.652304 0.603553 0.446646 -1.040729 0.025822 0.001113 -0.016301 0.030557 0.021589 -0.022424 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-0.028312 0.070056 -0.056920 0.024259 0.032661 12.458808 18.609128 -4.574262 2.817930 11.972276 -3.425927 6.795019 0.001292 505 C 22.932294 11.243950 5.327096 -0.155358 33.598582 0.40881276E+03 0.94428540E+04 8.987966 6.707162 0.167200 2.026972 0.999715 28.861190 81.628996 0.642603 0.412652 -1.069066 -0.014692 -0.005772 0.002900 0.016049 0.018793 0.005670 -0.012547 -0.022883 0.011770 -0.027992 0.004120 0.023873 11.096127 12.013108 -3.927181 -2.979548 14.814301 3.319454 6.460972 0.003721 506 C 21.105494 9.802951 5.721878 -0.149248 33.349351 0.39902153E+03 0.91639867E+04 8.925720 6.599442 0.188329 2.038241 0.999724 28.628308 80.824338 0.651581 0.409307 -1.070895 0.009936 0.016909 -0.001099 0.019642 0.016076 -0.000821 -0.004974 0.036968 0.015136 -0.027607 0.005260 0.022347 11.107286 10.091629 -3.148541 -2.269478 17.146113 3.110289 6.084115 0.004724 507 C 19.387079 13.291214 9.676830 0.628153 24.126246 0.23923806E+03 0.48978959E+04 7.736559 5.476907 0.050894 2.080813 0.999567 21.816294 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16.182066 7.988039 0.026630 37.699466 0.40098089E+03 0.91478488E+04 9.762500 6.623677 0.033890 2.027210 0.999313 26.059850 71.463692 0.654342 0.410304 -1.078717 -0.041639 0.009434 0.016763 0.045867 0.007692 0.015215 -0.015011 -0.027426 0.054710 -0.032079 0.002561 0.029518 13.662204 23.595492 -2.288589 -5.769713 10.214737 1.747468 7.176381 0.018064 530 C 3.313252 -1.544332 19.833979 0.623946 25.210583 0.24006285E+03 0.49143319E+04 7.917915 5.476101 0.034581 2.072017 0.999527 21.838959 60.541418 0.638730 0.468435 -1.023005 -0.017113 -0.005682 -0.066334 0.068741 -0.072145 -0.008023 -0.006461 -0.011312 -0.238120 -0.081538 -0.030518 0.112055 10.369415 7.805805 3.106903 0.740327 7.211950 0.273007 16.090489 0.001301 531 C 12.154658 15.633147 8.388304 0.087463 27.996552 0.31773298E+03 0.69169535E+04 8.061735 5.974201 0.202913 2.081646 0.999803 25.706862 71.461272 0.667921 0.421239 -1.059569 0.008642 0.052633 0.013113 0.054926 0.025990 0.019855 -0.008806 -0.044990 0.061398 -0.051189 0.024121 0.027068 9.875262 14.980459 -0.288724 -3.031074 8.924979 1.115111 5.720348 0.005283 532 C 15.811379 15.814846 7.522525 0.615730 24.100653 0.23656790E+03 0.48228200E+04 7.692462 5.427665 0.099801 2.101863 0.999630 21.635579 59.762976 0.643368 0.466983 -1.024275 0.067328 -0.017041 -0.017743 0.071682 0.011953 0.066748 0.013392 0.001941 0.261125 -0.072069 -0.044991 0.117060 10.136023 15.558161 -1.815360 -3.889763 9.091247 0.157317 5.758661 0.010586 533 C 12.861794 17.771861 8.772121 0.081265 28.903398 0.33293790E+03 0.73323702E+04 8.235447 6.119575 0.171978 2.066501 0.999743 26.070273 72.866712 0.659348 0.421804 -1.059328 -0.023087 -0.050620 -0.004807 0.055843 0.008016 0.016190 0.002898 -0.066861 0.059279 -0.047934 0.019281 0.028653 10.101680 14.890079 -1.116114 -3.179023 9.447819 1.416211 5.967144 0.006668 534 C 3.587696 -1.373215 21.280692 -0.031935 38.334430 0.41021826E+03 0.94224143E+04 9.832967 6.672196 0.009018 2.011933 0.999351 26.738838 73.840887 0.655247 0.406962 -1.079733 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0.84543099E+04 10.612613 6.656602 -0.368697 1.898379 0.998940 26.004845 74.647877 0.603667 0.446564 -1.040795 0.004194 -0.006505 0.029535 0.030532 -0.035827 -0.010906 0.003405 0.020203 0.059107 -0.047304 0.012291 0.035013 16.157092 8.709884 2.466095 4.708264 8.565440 -0.317966 31.195953 0.000837 538 C 16.824237 15.663632 1.743622 -0.095972 34.564027 0.40447277E+03 0.93485633E+04 9.288840 6.725032 0.058964 1.991993 0.999656 28.825214 82.438535 0.632004 0.419306 -1.061286 -0.005256 -0.019205 -0.021876 0.029580 0.007133 -0.002363 0.006257 -0.015143 -0.067641 -0.023902 0.001669 0.022233 11.998499 6.790858 1.346519 4.979510 9.358029 1.512323 19.846610 0.000562 539 C 4.463606 -0.387587 21.704809 -0.098267 35.070729 0.41510491E+03 0.96459277E+04 9.356149 6.807296 0.079368 1.996178 0.999666 28.947542 82.707567 0.629647 0.418623 -1.062909 -0.001302 -0.012888 0.026909 0.029864 0.009157 -0.012281 -0.016299 -0.013497 -0.034162 -0.022392 -0.005147 0.027539 11.847075 7.493755 2.715150 1.775837 7.930647 0.696136 20.116822 0.000639 540 C 3.335435 -2.059031 23.547127 -0.159407 35.704612 0.41238907E+03 0.96312470E+04 9.572595 6.846865 -0.014326 1.969159 0.999515 29.801209 87.245110 0.615210 0.426292 -1.051049 -0.004206 -0.004204 -0.028444 0.029059 -0.000727 -0.027663 0.002248 0.000636 -0.083770 -0.041666 0.013508 0.028158 12.387396 8.126256 2.893683 3.471844 7.913362 1.503245 21.122571 0.002248 541 C 4.712084 -0.245120 23.064616 -0.163724 37.003009 0.41612778E+03 0.97348605E+04 9.772445 6.849399 -0.026291 1.960453 0.999667 29.971509 87.650764 0.619289 0.422775 -1.053840 -0.002954 0.000727 -0.037753 0.037876 -0.002602 -0.000437 0.008782 -0.007823 -0.148182 -0.050371 0.020058 0.030313 12.672124 7.075170 2.311994 1.279584 8.347253 -0.961382 22.593948 0.001534 542 C 16.436980 13.359046 2.132922 -0.102775 34.011755 0.39968193E+03 0.92114146E+04 9.144884 6.646298 0.061294 1.993465 0.999710 28.843817 82.404641 0.641236 0.414454 -1.064256 0.003666 0.011847 -0.023584 0.026646 -0.001280 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1003 O -8.397629 -3.685879 21.151566 -0.581977 41.726135 0.60880823E+03 0.15180907E+05 9.856873 7.842419 0.115765 2.076918 0.996053 28.800078 78.501187 0.648393 0.378836 -1.117605 0.053396 0.024196 0.007993 0.059165 -0.039079 -0.018693 0.042453 0.042258 0.161367 -0.077538 -0.003492 0.081031 12.155709 18.353291 -5.612207 1.698624 10.984624 -1.633112 7.129212 0.026715 1004 O -7.556658 -1.929607 18.095840 -0.583504 39.537285 0.55336515E+03 0.13410512E+05 9.322390 7.327460 0.123544 2.090570 0.996075 27.829290 73.655666 0.694618 0.363853 -1.134191 -0.035127 -0.019654 -0.013859 0.042571 -0.001322 0.037369 -0.004806 -0.042590 -0.130470 -0.064983 0.021259 0.043724 11.543895 11.839722 4.192795 4.430980 9.940760 4.920678 12.851204 0.000896 1005 O -6.470548 -2.549889 20.923743 -0.573221 38.794074 0.54447658E+03 0.13116024E+05 9.149709 7.230666 0.150687 2.101003 0.996554 27.542754 72.214064 0.706113 0.360088 -1.139378 -0.025373 -0.018943 0.023293 0.039309 0.039056 -0.020071 0.007987 -0.064035 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-0.573242 38.797596 0.54453682E+03 0.13117777E+05 9.150198 7.231022 0.150842 2.101050 0.996554 27.542884 72.214138 0.706106 0.360084 -1.139387 -0.009401 -0.030216 -0.023311 0.039304 0.050501 -0.014109 0.016429 0.000714 0.084320 -0.069343 0.032328 0.037015 11.279727 16.120150 3.886778 4.347886 10.051694 2.068175 7.667335 0.003566 1012 O -1.638877 14.986563 8.388578 -0.578968 40.502013 0.54777220E+03 0.13229975E+05 9.451553 7.272754 0.133719 2.093289 0.996602 27.712734 73.018412 0.700355 0.362100 -1.136533 -0.026678 -0.007984 -0.027790 0.039341 -0.030298 0.035502 0.037904 -0.001890 -0.036580 -0.070451 0.032997 0.037454 12.054263 9.231898 3.033661 4.590555 8.889288 4.337238 18.041603 0.000536 1013 O -10.633597 -2.059672 22.652836 -0.591327 41.681039 0.62156515E+03 0.15584085E+05 9.856461 7.924359 0.044045 2.050061 0.996222 29.035072 79.433839 0.644820 0.378855 -1.117267 0.014906 0.044704 0.034024 0.058123 -0.049777 0.001471 0.015619 0.083634 -0.037997 -0.063033 -0.008646 0.071679 11.874158 7.872011 -1.658989 -3.973603 10.369992 4.112197 17.380470 0.026451 1014 O -3.163940 13.424312 7.880296 -0.594508 41.772383 0.57858942E+03 0.14155207E+05 9.624478 7.464871 0.140425 2.089558 0.996433 28.080805 74.266555 0.693194 0.361165 -1.138201 0.020888 0.030786 -0.015488 0.040298 -0.008981 -0.029300 -0.020904 0.014379 -0.168147 -0.070251 0.026041 0.044210 11.934970 12.898623 5.825067 -4.243800 10.936667 -3.649172 11.969621 0.000694 1015 O 10.614782 2.118535 8.979107 -0.582020 41.754448 0.60929271E+03 0.15196808E+05 9.863632 7.847477 0.115575 2.076851 0.996050 28.804825 78.537491 0.647909 0.379023 -1.117409 -0.022685 -0.045936 0.029635 0.059186 -0.066622 -0.036338 0.017566 -0.003162 0.051643 -0.077488 -0.003551 0.081039 12.164942 7.807449 0.599125 0.979370 7.480802 -2.653711 21.206574 0.026720 1016 O 7.011553 2.315435 8.651767 -0.583469 39.535361 0.55334837E+03 0.13409894E+05 9.321810 7.327224 0.123538 2.090583 0.996075 27.828173 73.650154 0.694653 0.363841 -1.134210 0.009661 0.037660 -0.017333 0.042569 0.027728 0.039080 -0.002373 -0.056885 0.048099 -0.065054 0.021146 0.043907 11.543026 7.209888 -1.402419 -0.689383 20.166002 -2.319825 7.253189 0.000896 1017 O 9.250897 0.584313 9.896702 -0.573249 38.794873 0.54449022E+03 0.13116431E+05 9.149855 7.230718 0.150761 2.101018 0.996553 27.543283 72.215604 0.706117 0.360084 -1.139382 0.036418 0.011123 -0.009763 0.039311 0.004303 -0.007185 0.026235 0.007921 -0.184298 -0.069274 0.032302 0.036971 11.279337 14.316481 5.204775 4.323004 9.089618 2.033317 10.431911 0.003564 1018 O -2.175211 11.453085 9.990737 -0.578966 40.504930 0.54782058E+03 0.13231452E+05 9.452083 7.273195 0.133827 2.093325 0.996603 27.712589 73.019191 0.700315 0.362112 -1.136522 0.035311 0.001858 0.017161 0.039304 0.012493 -0.000505 -0.013010 0.100034 0.103553 -0.070387 0.032933 0.037454 12.054801 21.820553 -0.848342 1.693023 8.085895 0.239356 6.257955 0.000536 1019 O 8.404312 3.636448 7.493190 -0.591351 41.705162 0.62198145E+03 0.15598058E+05 9.862795 7.929096 0.043728 2.049962 0.996218 29.039537 79.470448 0.644335 0.379054 -1.117054 -0.053871 -0.017185 0.013660 0.058172 -0.015293 0.006978 0.023283 0.039117 0.202464 -0.063090 -0.008927 0.072017 11.882538 15.257747 -4.085047 -5.590462 10.114903 1.833039 10.274964 0.026459 1020 O -0.515395 12.920048 10.333979 -0.594510 41.772480 0.57858649E+03 0.14155113E+05 9.624481 7.464835 0.140304 2.089522 0.996433 28.080841 74.266530 0.693199 0.361163 -1.138202 -0.008830 -0.039310 0.000717 0.040296 0.023208 -0.007442 0.010005 -0.088711 0.117095 -0.070426 0.026031 0.044394 11.935095 8.554541 0.600715 0.546131 20.497822 3.125005 6.752921 0.000693 1021 O 14.488687 25.368563 2.816663 -1.032990 62.356958 0.12811542E+04 0.38070509E+05 12.396378 10.961617 -0.225055 1.869546 0.997081 36.840004 105.883524 0.586057 0.351705 -1.150712 0.007046 -0.005016 -0.008646 0.012229 0.008428 -0.009557 -0.000252 -0.018425 -0.021482 -0.017082 0.000361 0.016721 14.977027 12.510810 2.123083 -3.033175 19.560401 -1.057911 12.859869 -0.008092 1022 O -3.296209 14.202140 10.891060 -1.033055 62.362286 0.12813075E+04 0.38076165E+05 12.397081 10.962304 -0.225201 1.869480 0.997075 36.841791 105.889820 0.586037 0.351707 -1.150711 -0.007047 0.005014 0.008663 0.012241 0.012313 -0.002712 0.009375 0.003857 -0.021429 -0.017171 0.000358 0.016813 14.977863 17.442345 3.866679 -0.013340 14.630317 3.213332 12.860927 -0.008093 1023 O 25.680852 5.583288 4.037199 -1.033051 62.362009 0.12813010E+04 0.38075925E+05 12.397048 10.962279 -0.225207 1.869479 0.997075 36.841703 105.889540 0.586037 0.351708 -1.150711 0.007060 -0.004980 0.008675 0.012243 -0.012450 -0.002269 0.009069 -0.003748 0.022699 -0.017173 0.000359 0.016813 14.977820 12.511922 -3.687981 -0.321487 15.450811 3.431024 16.970727 -0.008094 1024 O 7.896032 18.159186 9.670525 -1.032991 62.357036 0.12811560E+04 0.38070576E+05 12.396388 10.961625 -0.225054 1.869546 0.997081 36.840025 105.883592 0.586057 0.351705 -1.150712 -0.007043 0.004983 -0.008667 0.012229 -0.008559 -0.009105 -0.000545 0.018562 0.022760 -0.017082 0.000360 0.016722 14.977039 17.442685 -1.944693 -3.341545 10.519263 -0.839768 16.969169 -0.008092 1025 O 3.296538 16.533096 20.561585 -1.033053 62.362143 0.12813042E+04 0.38076044E+05 12.397064 10.962292 -0.225204 1.869479 0.997075 36.841745 105.889676 0.586037 0.351708 -1.150711 0.007077 0.009990 0.000025 0.012243 0.004256 0.012115 -0.008356 -0.003021 0.024941 -0.017172 0.000358 0.016813 14.977841 12.512403 1.565709 3.356161 13.618987 -2.371574 18.802131 -0.008092 1026 O 19.088234 15.123621 6.853862 -1.032993 62.357119 0.12811582E+04 0.38070654E+05 12.396399 10.961634 -0.225052 1.869546 0.997081 36.840053 105.883683 0.586056 0.351705 -1.150712 -0.007077 -0.009971 -0.000018 0.012227 -0.003620 0.012166 -0.008390 0.002514 -0.025144 -0.017082 0.000360 0.016722 14.977051 17.442727 -1.921541 3.355545 16.083983 -2.372068 11.404443 -0.008093 1027 O -13.491812 9.540539 24.598784 -1.033056 62.362364 0.12813096E+04 0.38076240E+05 12.397092 10.962314 -0.225201 1.869480 0.997075 36.841812 105.889891 0.586036 0.351708 -1.150711 0.007076 -0.004972 0.008663 0.012241 0.008364 0.009743 0.000568 -0.018478 -0.021429 -0.017172 0.000358 0.016813 14.977873 12.512428 2.123704 3.034009 19.560258 1.058522 12.860933 -0.008092 1028 O 2.299884 -1.626036 16.524387 -1.032995 62.357266 0.12811620E+04 0.38070793E+05 12.396416 10.961649 -0.225050 1.869546 0.997081 36.840102 105.883841 0.586056 0.351705 -1.150712 -0.007076 0.004969 -0.008644 0.012226 0.012346 0.002948 -0.009094 0.003735 -0.021482 -0.017081 0.000359 0.016722 14.977070 17.442752 3.866766 0.013633 14.628556 -3.212352 12.859900 -0.008092 1029 O -2.299663 -10.244759 23.378248 -1.032995 62.357288 0.12811623E+04 0.38070806E+05 12.396419 10.961651 -0.225049 1.869546 0.997081 36.840106 105.883855 0.586056 0.351705 -1.150712 0.007044 -0.004978 -0.008665 0.012226 -0.012491 0.002521 -0.008766 -0.003678 0.022760 -0.017082 0.000360 0.016722 14.977075 12.510851 -3.688364 0.322102 15.451168 -3.430377 16.969205 -0.008092 1030 O 13.492141 2.331032 17.744922 -1.033057 62.362435 0.12813111E+04 0.38076293E+05 12.397100 10.962319 -0.225199 1.869480 0.997075 36.841835 105.889963 0.586036 0.351707 -1.150711 -0.007046 0.004995 0.008673 0.012240 -0.008505 0.009307 0.000883 0.018565 0.022698 -0.017172 0.000358 0.016814 14.977885 17.442381 -1.944864 3.342003 10.520474 0.840558 16.970800 -0.008092 1031 O 8.892502 0.704737 6.853862 -1.033057 62.362412 0.12813105E+04 0.38076274E+05 12.397097 10.962318 -0.225200 1.869480 0.997075 36.841827 105.889942 0.586036 0.351707 -1.150711 0.007058 0.010001 0.000025 0.012241 0.004259 -0.011917 0.008637 -0.003000 0.024942 -0.017172 0.000358 0.016814 14.977882 12.511971 1.565543 -3.354668 13.619483 2.373720 18.802192 -0.008092 1032 O -8.892318 -0.704479 20.561585 -1.032989 62.356890 0.12811526E+04 0.38070451E+05 12.396370 10.961611 -0.225057 1.869546 0.997081 36.839985 105.883463 0.586057 0.351705 -1.150712 -0.007044 -0.009998 -0.000018 0.012230 -0.003605 -0.011965 0.008674 0.002594 -0.025144 -0.017082 0.000361 0.016721 14.977013 17.442653 -1.921531 -3.354898 16.083968 2.372953 11.404417 -0.008093 ****************************************************** Auxiliary information for the entire system The total spin magnetic moment of the unit cell is 7.446327 The total net atomic charge of the unit cell is 0.000013 Accuracy of reproducing the electrostatic potential in the unit cell: The inner radius (bohr) = 5.0000 The outer radius (bohr) = 12.0000 Valid grid points have density less than (e/(bohr^3)) = 0.0001 The number of valid grid points were= 4247250 The rms potential error without charges in kcal/mol is= 3.81242 The rms potential error with partial charges in kcal/mol is= 1.51363 The RRMSE value at monopole order= 0.39703 The rms potential error with partial charges and cloud penetration in kcal/mol is= 1.50120 The RRMSE value at monopole order with cloud penetration is= 0.39376 The rms potential error with partial charges and atomic dipoles in kcal/mol is= 0.87128 The RRMSE value at dipole order= 0.22854 The rms potential error with partial charges, atomic dipoles and cloud penetration in kcal/mol is= 0.85562 The RRMSE value at dipole order with cloud penetration= 0.22443 ****************************************************** The electron densities and ab initio electrostatic potential were computed in VASP using the PBE functional and projector augmented wave method. See the main text of the journal article for a description of computational details. The atomic charges, dipoles, and quadrupoles were computed with the DDEC6 method as described in (a) T. A. Manz and N. Gabaldon Limas, RSC Adv. 6 (2016) 47771-47801 DOI: 10.1039/c6ra04656h (b) N. Gabaldon Limas and T. A. Manz, RSC Adv. 8 (2018) 2678-2707 DOI: 10.1039/c7ra11829e. For each atom in the material, the electron cloud parameters were fit to the spherically averaged atom-in-material electron density using radial positions for which this density was between 10^-4 and 10^-2 electrons per cubic bohr. The polarizabilities, dispersion coefficients, and quantum Drude oscillator (QDO) parameters were fit using the MCLF method. The magnetic structure of the system was optimized in VASP from the default ferromagnetic initial guess using spin polarization. The atomic spin moments (ASMs) were computed on this optimized magnetic structure using the DDEC6 partition as inputs to the method of T. A. Manz and D. S. Sholl, J. Chem. Theory Comput. 7 (2011) 4146-4164 DOI: 10.1021/ct200539n. The RMSE and RRMSE were computed using a uniform grid with Ewald summation.