1024 jmolscript: load "" {1 1 1} spacegroup "x,y,z" unitcell [{ 17.442000 0.000000 0.000000 }, { 8.720983 28.844348 0.000000 }, { 8.721033 -0.000038 28.844332 }] Mn 12.654101 4.142892 16.831245 0.941579 Mn 16.270092 1.027701 17.816279 0.955545 Mn 8.843109 2.261666 14.477259 0.932097 Mn 21.374934 10.279225 26.435253 0.939281 Mn 24.991093 13.394416 25.450219 0.955402 Mn 17.564120 12.160451 28.789239 0.928243 Mn 25.735511 12.013070 18.565366 0.943439 Mn 11.909670 11.027751 15.449890 0.954487 Mn 21.924605 14.367059 16.683850 0.933240 Mn 17.014523 2.409047 24.701132 0.942736 Mn 20.630515 3.394366 27.816608 0.954845 Mn 13.203624 0.055058 26.582648 0.932067 Mn 22.229915 24.701418 12.013087 0.941570 Mn 18.613924 27.816609 11.028053 0.955505 Mn 26.040907 26.582644 14.367073 0.932100 Mn 13.509082 18.565085 2.409079 0.941702 Mn 9.892923 15.449894 3.394113 0.952877 Mn 17.319896 16.683859 0.055093 0.932197 Mn 9.148505 16.831240 10.278966 0.943354 Mn 22.974346 17.816559 13.394442 0.954469 Mn 12.959411 14.477251 12.160482 0.933286 Mn 17.869493 26.435263 4.143200 0.942739 Mn 14.253501 25.449944 1.027724 0.954600 Mn 21.680392 28.789252 2.261684 0.932069 H 11.117551 5.535203 20.626582 0.125314 H 11.916397 5.307330 22.763947 0.093642 H 13.789669 3.951645 23.196612 0.111506 H 14.796071 2.846909 21.434223 0.104367 H 15.760607 1.306630 14.609654 0.128438 H 14.663504 1.892171 13.597218 0.131531 H 16.997244 3.392076 14.543312 0.091984 H 15.854791 4.072804 13.643369 0.097993 H 16.442585 2.947877 11.803101 0.086960 H 17.056545 1.727760 12.630933 0.098291 H 18.080389 4.136263 12.304992 0.081824 H 18.690861 2.942106 13.176091 0.083697 H 18.247831 2.595978 10.268582 0.141878 H 19.672842 3.051718 10.833931 0.142145 H 19.102490 1.595078 11.182948 0.137884 H 12.788490 7.326442 17.070076 0.094003 H 14.262338 9.100369 17.159493 0.125479 H 17.281549 6.472649 16.868165 0.118129 H 15.757119 4.767949 16.847974 0.091016 H 16.618752 9.818593 17.658500 0.113008 H 16.772240 9.662835 16.077831 0.121813 H 19.198427 4.214136 17.274870 0.126252 H 21.164139 4.268942 16.083600 0.094686 H 21.917633 2.394061 14.883675 0.117990 H 20.525762 0.542254 14.745223 0.109857 H 22.180995 26.678116 16.542224 0.128677 H 23.384493 25.749328 16.040333 0.129394 H 22.716467 26.106995 18.803620 0.092583 H 22.257742 24.837844 17.949828 0.099002 H 24.971718 25.478188 18.590172 0.092762 H 24.563574 24.255189 17.649847 0.097251 H 23.862409 24.448442 20.410249 0.086955 H 23.466475 23.216790 19.467040 0.084028 H 26.156032 23.894631 20.162188 0.138190 H 25.350213 22.654324 20.767919 0.134731 H 25.756610 22.662979 19.224747 0.136463 H 6.966346 5.535214 12.319414 0.129122 H 7.348324 7.799495 12.385756 0.095740 H 9.014036 8.705206 13.741440 0.110228 H 10.386724 7.271640 14.932711 0.108226 H 12.216396 1.023951 17.615234 0.127030 H 20.368770 28.590496 16.827783 0.125266 H 18.328057 28.763560 18.114240 0.087926 H 19.597836 28.405889 19.014184 0.093082 H 9.757075 2.160417 18.780545 0.091140 H 11.042552 1.820052 19.663181 0.097093 H 8.412299 0.847997 20.208339 0.070919 H 9.696032 0.473020 21.085207 0.081054 H 9.875684 2.662305 21.838044 0.138274 H 8.377417 2.163297 22.100527 0.130023 H 8.696603 3.129584 20.863105 0.134730 H 20.262381 12.388628 14.967324 0.087710 H 19.097257 10.381061 15.030781 0.124632 H 19.174006 10.606042 19.034375 0.119627 H 20.436806 12.504000 18.867078 0.088045 H 18.563534 8.338879 16.374927 0.113503 H 18.404814 8.480215 17.964250 0.111503 H 19.838551 8.886914 22.639916 0.124895 H 20.637392 9.114787 20.502551 0.093698 H 22.510662 10.470472 20.069886 0.111916 H 23.517067 11.575208 21.832275 0.105204 H 24.481616 13.115487 28.656844 0.127829 H 14.663483 12.529984 0.824948 0.130512 H 25.718255 11.030041 28.723186 0.091937 H 15.854773 10.349351 0.778797 0.098239 H 16.442570 11.474278 2.619065 0.087506 H 17.056526 12.694395 1.791233 0.097041 H 18.080374 10.285892 2.117174 0.082066 H 18.690842 11.480049 1.246075 0.082295 H 18.247818 11.826177 4.153584 0.142270 H 19.672829 11.370437 3.588235 0.142312 H 19.102475 12.827077 3.239218 0.139120 H 21.509500 7.095675 26.196422 0.095702 H 22.983350 5.321748 26.107005 0.124928 H 26.002559 7.949468 26.398333 0.118078 H 24.478127 9.654168 26.418524 0.090785 H 25.339764 4.603524 25.607998 0.113238 H 25.493256 4.759282 27.188667 0.121607 H 27.919433 10.207981 25.991628 0.126674 H 12.443148 10.153175 27.182898 0.094427 H 13.196643 12.028056 28.382823 0.118566 H 29.246770 13.879863 28.521275 0.111071 H 22.181012 16.588349 26.724274 0.129034 H 23.384510 17.517137 27.226165 0.129923 H 22.716479 17.159470 24.462878 0.093174 H 22.257754 18.428621 25.316670 0.098070 H 24.971729 17.788277 24.676326 0.094136 H 24.563587 19.011276 25.616651 0.096427 H 23.862415 18.818023 22.856249 0.086140 H 23.466482 20.049675 23.799458 0.083800 H 26.156038 19.371834 23.104310 0.137631 H 25.350216 20.612141 22.498579 0.133487 H 25.756617 20.603486 24.041751 0.136636 H 6.966332 8.886941 2.102752 0.129523 H 7.348313 6.622660 2.036410 0.094225 H 9.014023 5.716949 0.680726 0.110340 H 19.107739 7.150477 28.333787 0.109325 H 20.937398 13.398166 25.651264 0.127287 H 20.368789 14.675969 26.438715 0.124895 H 18.328074 14.502905 25.152258 0.087032 H 19.597850 14.860576 24.252314 0.093356 H 18.478076 12.261700 24.485953 0.090816 H 19.763550 12.602065 23.603317 0.096604 H 17.133295 13.574120 23.058159 0.070735 H 18.417025 13.949097 22.181291 0.080081 H 18.596678 11.759812 21.428454 0.138581 H 17.098410 12.258820 21.165971 0.129764 H 17.417600 11.292533 22.403393 0.134537 H 11.541403 2.033489 28.299174 0.088489 H 10.376276 4.041056 28.235717 0.123678 H 10.453016 3.816075 24.232123 0.120528 H 11.715818 1.918117 24.399420 0.087262 H 27.284548 6.083238 26.891571 0.112160 H 9.683824 5.941902 25.302248 0.111061 H 24.199049 8.217728 19.957393 0.125551 H 24.997893 6.080363 19.729523 0.092722 H 9.429163 5.647699 18.373839 0.111393 H 10.435564 7.410090 17.269102 0.103954 H 11.400101 14.234665 15.728814 0.128155 H 10.302999 15.247101 16.314354 0.130786 H 12.636741 14.301004 17.814259 0.091116 H 11.494290 15.200947 18.494986 0.097980 H 12.082083 17.041218 17.370057 0.087339 H 12.696041 16.213387 16.149941 0.097587 H 13.719889 16.539325 18.558443 0.081290 H 14.330358 15.668227 17.364288 0.082925 H 13.887329 18.575738 17.018156 0.142074 H 15.312341 18.010388 17.473896 0.142549 H 14.741986 17.661373 16.017258 0.138982 H 25.869992 11.774234 21.748626 0.094818 H 27.343843 11.684814 23.522553 0.124694 H 12.921050 11.976146 20.894834 0.117842 H 11.396618 11.996339 19.190134 0.091209 H 12.258259 11.185806 24.240777 0.113383 H 12.411747 12.766477 24.085017 0.121579 H 14.837924 11.569443 18.636323 0.127272 H 16.803637 12.760715 18.691127 0.094140 H 17.557128 13.960642 16.816246 0.117057 H 16.165254 14.099098 14.964439 0.110877 H 9.099498 12.302098 12.255957 0.129139 H 10.302995 12.803991 11.327169 0.129430 H 9.634968 10.040702 11.684839 0.093110 H 9.176242 10.894497 10.415688 0.097728 H 11.890218 10.254151 11.056032 0.095202 H 11.482073 11.194479 9.833033 0.097043 H 10.780907 8.434074 10.026290 0.086425 H 10.384971 9.377286 8.794637 0.082750 H 13.074529 8.682136 9.472479 0.137089 H 12.268707 8.076407 8.232172 0.135350 H 12.675105 9.619579 8.240826 0.136046 H 20.047848 16.524901 19.957393 0.129183 H 20.429830 16.458556 22.221673 0.094886 H 22.095543 15.102870 23.127385 0.108973 H 23.468228 13.911600 21.693822 0.109173 H 25.297888 11.229084 15.446140 0.127262 H 24.729277 12.016537 14.168336 0.125902 H 22.688564 10.730079 14.341402 0.086491 H 23.958341 9.830135 13.983732 0.093272 H 22.838568 10.063771 16.582606 0.092153 H 24.124043 9.181135 16.242243 0.095907 H 21.493789 8.635978 15.270189 0.071310 H 22.777520 7.759110 14.895213 0.080879 H 22.957176 7.006270 17.084498 0.138282 H 21.458908 6.743787 16.585491 0.130003 H 21.778097 7.981208 17.551776 0.135673 H 15.901894 13.876981 26.810807 0.089961 H 14.736766 13.813526 24.803241 0.124598 H 14.813513 9.809930 25.028227 0.121122 H 16.076316 9.977225 26.926184 0.086331 H 14.203039 12.469382 22.761062 0.112998 H 14.044318 10.880058 22.902400 0.111033 H 15.478054 6.204389 23.309105 0.125743 H 16.276896 8.341754 23.536975 0.093124 H 18.150169 8.774418 24.892659 0.111575 H 19.156574 7.012027 25.997396 0.104647 H 20.121123 0.187452 27.537684 0.129102 H 27.745004 28.019364 26.952144 0.131346 H 21.357758 0.121113 25.452239 0.091380 H 28.936290 28.065518 24.771512 0.098008 H 29.524088 26.225247 25.896441 0.088540 H 30.138047 27.053078 27.116557 0.097847 H 31.161890 26.727140 24.708055 0.081478 H 31.772361 27.598238 25.902210 0.083699 H 31.329336 24.690727 26.248342 0.142009 H 32.754346 25.256077 25.792602 0.141521 H 32.183994 25.605092 27.249240 0.138755 H 17.148997 2.647883 21.517872 0.094932 H 18.622844 2.737303 19.743945 0.125466 H 21.642058 2.445971 22.371664 0.117246 H 20.117629 2.425778 24.076364 0.092028 H 20.979257 3.236311 19.025721 0.114161 H 21.132748 1.655640 19.181481 0.122276 H 23.558936 2.852674 24.630175 0.125813 H 8.082650 1.661402 24.575371 0.094278 H 8.836147 0.461475 26.450252 0.118444 H 24.886278 0.323019 28.302059 0.110115 H 9.099493 2.120057 2.166209 0.128729 H 10.302992 1.618164 3.094997 0.129448 H 9.634961 4.381453 2.737327 0.092379 H 9.176239 3.527658 4.006478 0.097322 H 11.890213 4.168004 3.366134 0.094186 H 11.482072 3.227676 4.589133 0.096735 H 10.780902 5.988081 4.395876 0.086026 H 10.384970 5.044869 5.627529 0.082855 H 13.074525 5.740019 4.949687 0.137622 H 12.268706 6.345748 6.189994 0.134009 H 12.675106 4.802576 6.181340 0.135912 H 20.047846 26.741564 23.309105 0.129046 H 20.429823 26.807909 21.044825 0.094495 H 22.095532 28.163595 20.139113 0.110183 H 14.747235 0.510517 21.572676 0.108753 H 16.576907 3.193033 27.820358 0.127205 H 7.287266 2.405618 0.253830 0.124693 H 5.246552 3.692076 0.080764 0.087098 H 6.516329 4.592020 0.438434 0.092433 H 14.117583 4.358346 26.683892 0.090978 H 15.403058 5.240982 27.024255 0.096238 H 12.772805 5.786139 27.996309 0.070649 H 14.056536 6.663007 28.371285 0.079761 H 14.236186 7.415847 26.182000 0.138646 H 12.737919 7.678330 26.681007 0.130122 H 13.057107 6.440909 25.714722 0.135620 H 7.180890 0.545136 16.455691 0.088214 H 6.015767 0.608591 18.463257 0.124335 H 23.534509 4.612187 18.238271 0.120828 H 7.355307 4.444892 16.340314 0.087093 H 22.924043 1.952735 20.505436 0.114335 H 22.765320 3.542059 20.364098 0.111304 H 23.766465 23.309107 8.217750 0.125278 H 22.967619 23.536980 6.080385 0.093585 H 21.094347 24.892665 5.647720 0.111492 H 20.087945 25.997401 7.410109 0.104372 H 19.123409 27.537680 14.234678 0.128447 H 20.220512 26.952139 15.247114 0.131546 H 17.886772 25.452234 14.301020 0.091972 H 19.029225 24.771506 15.200963 0.097987 H 18.441431 25.896433 17.041231 0.086971 H 17.827471 27.116550 16.213399 0.098303 H 16.803627 24.708047 16.539340 0.081814 H 16.193155 25.902204 15.668241 0.083687 H 16.636185 26.248332 18.575750 0.141886 H 15.211174 25.792592 18.010401 0.142141 H 15.781526 27.249232 17.661384 0.137898 H 22.095526 21.517868 11.774256 0.093998 H 20.621678 19.743941 11.684839 0.125474 H 17.602467 22.371661 11.976167 0.118124 H 19.126897 24.076361 11.996358 0.091027 H 18.265264 19.025717 11.185832 0.112985 H 18.111776 19.181475 12.766501 0.121847 H 15.685589 24.630174 11.569462 0.126218 H 13.719877 24.575368 12.760732 0.094669 H 12.966383 26.450249 13.960657 0.117995 H 14.358254 28.302056 14.099109 0.109873 H 12.703021 2.166194 12.302108 0.128679 H 11.499523 3.094982 12.803999 0.129406 H 12.167549 2.737315 10.040712 0.092574 H 12.626274 4.006466 10.894504 0.099003 H 9.912298 3.366122 10.254160 0.092762 H 10.320442 4.589121 11.194485 0.097260 H 11.021607 4.395868 8.434083 0.086956 H 11.417541 5.627520 9.377292 0.084020 H 8.727984 4.949679 8.682144 0.138199 H 9.533803 6.189986 8.076413 0.134720 H 9.127406 6.181331 9.619585 0.136463 H 27.917670 23.309096 16.524918 0.129131 H 27.535692 21.044815 16.458576 0.095753 H 25.869980 20.139104 15.102892 0.110228 H 24.497292 21.572670 13.911621 0.108217 H 22.667620 27.820359 11.229098 0.127025 H 14.515246 0.253814 12.016549 0.125282 H 16.555959 0.080750 10.730092 0.087934 H 15.286180 0.438421 9.830148 0.093088 H 25.126941 26.683893 10.063787 0.091133 H 23.841464 27.024258 9.181151 0.097088 H 26.471717 27.996313 8.635993 0.070930 H 25.187984 28.371290 7.759125 0.081067 H 25.008332 26.182005 7.006288 0.138264 H 26.506599 26.681013 6.743805 0.130010 H 26.187413 25.714726 7.981227 0.134707 H 14.621635 16.455682 13.877008 0.087753 H 15.786759 18.463249 13.813551 0.124673 H 15.710010 18.238268 9.809957 0.119544 H 14.447210 16.340310 9.977254 0.087976 H 16.320482 20.505431 12.469405 0.113534 H 16.479202 20.364095 10.880082 0.111448 H 15.045465 19.957396 6.204416 0.125085 H 14.246624 19.729523 8.341781 0.093903 H 12.373354 18.373838 8.774446 0.112118 H 11.366949 17.269102 7.012057 0.105318 H 10.402400 15.728823 0.187488 0.127861 H 20.220533 16.314326 28.019384 0.130888 H 9.165761 17.814269 0.121146 0.091816 H 19.029243 18.494959 28.065535 0.098296 H 18.441446 17.370032 26.225267 0.087690 H 17.827490 16.149915 27.053099 0.097074 H 16.803642 18.558418 26.727158 0.082069 H 16.193174 17.364261 27.598257 0.082197 H 16.636198 17.018133 24.690748 0.142375 H 15.211187 17.473873 25.256097 0.142366 H 15.781541 16.017233 25.605114 0.139230 H 13.374516 21.748635 2.647910 0.095828 H 11.900666 23.522562 2.737327 0.125085 H 8.881457 20.894842 2.445999 0.118164 H 10.405889 19.190142 2.425808 0.090720 H 9.544252 24.240786 3.236334 0.113334 H 9.390760 24.085028 1.655665 0.121733 H 6.964583 18.636329 2.852704 0.126685 H 22.440868 18.691135 1.661434 0.094535 H 21.687373 16.816254 0.461509 0.118712 H 5.637246 14.964447 0.323057 0.111329 H 12.703004 12.255961 2.120058 0.129163 H 11.499506 11.327173 1.618167 0.130526 H 12.167537 11.684840 4.381454 0.093052 H 12.626262 10.415689 3.527662 0.098293 H 9.912287 11.056033 4.168006 0.094005 H 10.320429 9.833034 3.227681 0.096589 H 11.021601 10.026287 5.988083 0.086077 H 11.417534 8.794635 5.044874 0.083871 H 8.727978 9.472476 5.740022 0.137590 H 9.533800 8.232169 6.345753 0.133522 H 9.127399 8.240824 4.802581 0.136723 H 27.917684 19.957369 26.741580 0.129660 H 27.535703 22.221650 26.807922 0.094281 H 25.869993 23.127361 28.163606 0.110418 H 15.776277 21.693833 0.510545 0.109330 H 13.946618 15.446144 3.193068 0.126792 H 14.515227 14.168341 2.405617 0.125147 H 16.555942 14.341405 3.692074 0.087241 H 15.286166 13.983734 4.592018 0.093423 H 16.405940 16.582610 4.358379 0.090748 H 15.120466 16.242245 5.241015 0.096419 H 17.750721 15.270190 5.786173 0.070820 H 16.466991 14.895213 6.663041 0.080157 H 16.287338 17.084498 7.415878 0.138537 H 17.785606 16.585490 7.678361 0.129869 H 17.466416 17.551777 6.440939 0.134502 H 23.342613 26.810821 0.545158 0.088526 H 24.507740 24.803254 0.608615 0.123668 H 24.431000 25.028235 4.612209 0.120517 H 23.168198 26.926193 4.444912 0.087285 H 7.599468 22.761072 1.952761 0.112128 H 25.200192 22.902408 3.542084 0.111027 H 10.684967 20.626582 8.886939 0.125441 H 9.886123 22.763947 9.114809 0.092710 H 25.454853 23.196611 10.470493 0.111426 H 24.448452 21.434220 11.575230 0.103981 H 23.483915 14.609645 13.115518 0.128196 H 24.581017 13.597209 12.529978 0.130816 H 22.247275 14.543306 11.030073 0.091086 H 23.389726 13.643363 10.349346 0.097923 H 22.801933 11.803092 11.474275 0.087352 H 22.187975 12.630923 12.694391 0.097633 H 21.164127 12.304985 10.285889 0.081241 H 20.553658 13.176083 11.480044 0.082913 H 20.996687 10.268572 11.826176 0.142092 H 19.571675 10.833922 11.370436 0.142533 H 20.142030 11.182937 12.827074 0.139026 H 9.014024 17.070076 7.095706 0.094697 H 7.540173 17.159496 5.321779 0.124534 H 21.962966 16.868164 7.949498 0.117882 H 23.487398 16.847971 9.654198 0.091273 H 22.625757 17.658504 4.603555 0.113341 H 22.472269 16.077833 4.759315 0.121543 H 20.046092 17.274867 10.208009 0.127207 H 18.080379 16.083595 10.153205 0.094077 H 17.326888 14.883668 12.028086 0.117046 H 18.718762 14.745212 13.879893 0.110911 H 25.784518 16.542212 16.588375 0.129127 H 24.581021 16.040319 17.517163 0.129481 H 25.249048 18.803608 17.159493 0.093071 H 25.707774 17.949813 18.428644 0.097751 H 22.993798 18.590159 17.788300 0.095182 H 23.401943 17.649831 19.011299 0.097099 H 24.103109 20.410236 18.818042 0.086387 H 24.499045 19.467024 20.049695 0.082769 H 21.809487 20.162174 19.371853 0.137066 H 22.615309 20.767903 20.612160 0.135329 H 22.208911 19.224731 20.603506 0.136093 H 14.836168 12.319409 8.886939 0.129254 H 14.454186 12.385754 6.622659 0.094937 H 12.788473 13.741440 5.716947 0.108799 H 11.415788 14.932710 7.150510 0.109006 H 9.586128 17.615226 13.398192 0.127267 H 10.154739 16.827773 14.675996 0.125959 H 12.195452 18.114231 14.502930 0.086508 H 10.925675 19.014175 14.860600 0.093311 H 12.045448 18.780539 12.261726 0.092097 H 10.759973 19.663175 12.602089 0.095902 H 13.390227 20.208332 13.574143 0.071327 H 12.106496 21.085200 13.949119 0.080921 H 11.926840 21.838040 11.759834 0.138288 H 13.425108 22.100523 12.258841 0.130029 H 13.105919 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4.767968 0.092023 H 13.904759 25.607999 9.818611 0.114153 H 13.751268 27.188670 9.662851 0.122308 H 11.325080 25.991636 4.214157 0.125769 H 26.801366 27.182908 4.268961 0.094275 H 26.047869 28.382835 2.394080 0.118465 H 9.997738 28.521291 0.542273 0.110158 H 25.784523 26.724253 26.678123 0.128733 H 24.581024 27.226146 25.749335 0.129483 H 25.249055 24.462857 26.107005 0.092324 H 25.707777 25.316652 24.837854 0.097335 H 22.993803 24.676306 25.478198 0.094163 H 23.401944 25.616634 24.255199 0.096762 H 24.103114 22.856229 24.448456 0.086009 H 24.499046 23.799441 23.216803 0.082869 H 21.809491 23.104291 23.894645 0.137601 H 22.615310 22.498562 22.654338 0.134039 H 22.208910 24.041734 22.662992 0.135920 H 14.836170 2.102746 5.535227 0.129064 H 14.454193 2.036401 7.799507 0.094504 H 12.788484 0.680715 8.705219 0.110186 H 20.136781 28.333793 7.271656 0.108748 H 18.307109 25.651277 1.023974 0.127185 H 27.596750 26.438692 28.590502 0.124726 H 29.637464 25.152234 28.763568 0.087123 H 28.367687 24.252290 28.405898 0.092403 H 20.766433 24.485964 2.160440 0.091003 H 19.480958 23.603328 1.820077 0.096219 H 22.111211 23.058171 0.848023 0.070668 H 20.827480 22.181303 0.473047 0.079739 H 20.647830 21.428463 2.662332 0.138622 H 22.146097 21.165980 2.163325 0.130055 H 21.826909 22.403401 3.129610 0.135645 H 27.703126 28.299174 12.388641 0.088231 H 28.868249 28.235719 10.381075 0.124343 H 11.349507 24.232123 10.606061 0.120794 H 27.528709 24.399418 12.504018 0.087089 H 11.959973 26.891575 8.338896 0.114341 H 12.118696 25.302251 8.480234 0.111248 C 12.481515 4.343356 19.694333 0.321180 C 11.878023 4.985718 20.780322 -0.223776 C 12.347214 4.850437 22.049184 -0.079731 C 13.454782 4.047698 22.311379 -0.131538 C 14.046065 3.403893 21.262022 -0.085538 C 13.603037 3.526772 19.954797 -0.168737 C 14.326879 2.776820 18.896787 0.458090 C 14.489086 2.655967 15.502098 0.477646 C 15.277463 2.126098 14.337075 -0.309077 C 16.323982 3.222761 13.836338 -0.153106 C 17.005963 2.717121 12.581898 -0.163149 C 18.129227 3.149786 12.385756 -0.119741 C 18.863534 2.535404 11.027188 -0.462956 C 13.721637 7.150491 17.033155 0.112123 C 14.595480 8.214559 17.066326 -0.207241 C 15.938514 7.997650 16.965371 0.176863 C 16.353635 6.673983 16.904509 -0.214865 C 15.446651 5.663277 16.895279 0.096551 C 16.894335 9.192671 16.940276 -0.223376 C 18.657725 2.308391 16.785382 0.317693 C 19.465289 3.449762 16.781055 -0.242665 C 20.639135 3.477742 16.071196 -0.062994 C 21.082162 2.380792 15.334224 -0.132029 C 20.264132 1.279515 15.283458 -0.081661 C 19.064124 1.198462 15.990432 -0.167365 C 18.228652 0.015555 15.807271 0.462529 C 24.031591 27.489218 16.923546 0.484060 C 23.077514 26.333425 16.779613 -0.290516 C 22.974608 25.511937 18.057994 -0.157566 C 24.272294 24.800058 18.421433 -0.177645 C 24.157178 23.905593 19.636644 -0.119062 C 25.472306 23.218808 19.978450 -0.451313 C 8.462871 4.988035 13.606737 0.320548 C 7.669259 5.873846 12.862265 -0.228748 C 7.892516 7.222319 12.907550 -0.071597 C 8.886710 7.764015 13.695000 -0.128417 C 9.685555 6.912817 14.404283 -0.084891 C 9.498926 5.525404 14.377169 -0.175090 C 10.407656 4.710262 15.194617 0.460493 C 10.707662 1.497866 16.301951 0.484383 C 11.391390 0.588979 17.282370 -0.292568 C 10.463477 0.272843 18.463834 -0.156144 C 10.180917 1.460075 19.335510 -0.176784 C 9.284399 1.187783 20.535434 -0.111912 C 9.036723 2.391168 21.411148 -0.439010 C 20.058311 12.001247 15.811597 0.094179 C 19.353655 10.805360 15.842749 -0.216330 C 19.030980 10.235394 17.062288 0.187678 C 19.416449 10.928811 18.176833 -0.209473 C 20.143779 12.079701 18.067224 0.103265 C 18.251323 8.935956 17.098920 -0.229193 C 21.202516 10.078761 23.572165 0.319998 C 20.599022 9.436399 22.486176 -0.223847 C 21.068210 9.571680 21.217314 -0.078990 C 22.175777 10.374419 20.955119 -0.133284 C 22.767061 11.018224 22.004476 -0.085921 C 22.324036 10.895345 23.311701 -0.169806 C 23.047880 11.645297 24.369711 0.455776 C 23.210094 11.766150 27.764400 0.476684 C 15.277441 12.296057 0.085091 -0.307443 C 16.323962 11.199394 0.585828 -0.153437 C 17.005945 11.705034 1.840268 -0.162680 C 18.129210 11.272369 2.036410 -0.117178 C 18.863520 11.886751 3.394978 -0.465658 C 22.442647 7.271626 26.233343 0.108929 C 23.316492 6.207558 26.200172 -0.205498 C 24.659526 6.424467 26.301127 0.175916 C 25.074645 7.748134 26.361989 -0.214811 C 24.167660 8.758840 26.371219 0.095672 C 25.615348 5.229446 26.326222 -0.223527 C 27.378731 12.113726 26.481116 0.318050 C 28.186296 10.972355 26.485443 -0.242526 C 11.918143 10.944375 27.195302 -0.063398 C 12.361170 12.041325 27.932274 -0.131996 C 28.985140 13.142602 27.983040 -0.084911 C 27.785129 13.223655 27.276066 -0.164404 C 26.949657 14.406562 27.459227 0.460773 C 24.031608 15.777247 26.342952 0.484739 C 23.077531 16.933040 26.486885 -0.291460 C 22.974621 17.754528 25.208504 -0.157454 C 24.272305 18.466407 24.845065 -0.177756 C 24.157186 19.360872 23.629854 -0.118457 C 25.472312 20.047657 23.288048 -0.449395 C 8.462854 9.434120 0.815429 0.321632 C 7.669244 8.548309 1.559901 -0.231237 C 7.892502 7.199836 1.514616 -0.067146 C 8.886696 6.658140 0.727166 -0.130511 C 9.685538 7.509338 0.017883 -0.085523 C 9.498908 8.896751 0.044997 -0.178164 C 19.128668 9.711855 28.071881 0.459388 C 19.428667 12.924251 26.964547 0.484597 C 20.112392 13.833138 25.984128 -0.291772 C 19.184476 14.149274 24.802664 -0.157098 C 18.901915 12.962042 23.930988 -0.174306 C 18.005395 13.234334 22.731064 -0.111138 C 17.757718 12.030949 21.855350 -0.439134 C 11.337330 2.420870 27.454901 0.093316 C 10.632672 3.616757 27.423749 -0.214495 C 10.309994 4.186723 26.204210 0.185938 C 10.695461 3.493306 25.089665 -0.210112 C 11.422793 2.342416 25.199274 0.103595 C 26.972336 5.486161 26.167578 -0.226470 C 25.563011 9.149979 18.765546 0.320941 C 24.959519 8.063989 19.407909 -0.225183 C 7.986710 6.795126 19.272629 -0.077442 C 9.094276 6.532932 18.469891 -0.132298 C 9.685559 7.582290 17.826086 -0.083289 C 9.242531 8.889516 17.948962 -0.169985 C 9.966373 9.947528 17.199010 0.455040 C 10.128581 13.342219 17.078152 0.478476 C 10.916958 14.507243 16.548282 -0.308832 C 11.963479 15.007979 17.644943 -0.152059 C 12.645460 16.262421 17.139302 -0.162082 C 13.768725 16.458562 17.571967 -0.119197 C 14.503032 17.817131 16.957583 -0.464418 C 26.803139 11.811155 21.572676 0.110528 C 27.676985 11.777983 22.636743 -0.205645 C 11.578018 11.878938 22.419834 0.176154 C 11.993136 11.939802 21.096168 -0.213685 C 11.086151 11.949033 20.085462 0.095341 C 12.533841 11.904031 23.614855 -0.223159 C 14.297219 12.058935 16.730578 0.318044 C 15.104785 12.063260 17.871948 -0.244244 C 16.278632 12.773119 17.899927 -0.062562 C 16.721657 13.510094 16.802977 -0.130176 C 15.903626 13.560861 15.701701 -0.084354 C 14.703616 12.853886 15.620648 -0.165328 C 13.868143 13.037049 14.437742 0.460755 C 10.950096 11.920775 13.067059 0.482617 C 9.996017 12.064710 11.911267 -0.290760 C 9.893109 10.786329 11.089780 -0.156915 C 11.190793 10.422891 10.377902 -0.179906 C 11.075675 9.207680 9.483439 -0.117782 C 12.390802 8.865876 8.796656 -0.449850 C 21.544372 15.237578 19.410216 0.321085 C 20.750761 15.982050 20.296026 -0.229526 C 20.974020 15.936762 21.644498 -0.068883 C 21.968215 15.149311 22.186195 -0.128313 C 22.767058 14.440029 21.334999 -0.084719 C 22.580427 14.467145 19.947586 -0.177209 C 23.489155 13.649697 19.132445 0.458858 C 23.789155 12.542367 15.920052 0.485056 C 24.472881 11.561949 15.011167 -0.294110 C 23.544966 10.380485 14.695033 -0.154500 C 23.262408 9.508807 15.882266 -0.176289 C 22.365890 8.308882 15.609976 -0.112007 C 22.118215 7.433166 16.813361 -0.440354 C 15.697823 13.032707 26.423427 0.089225 C 14.993164 13.001557 25.227541 -0.214653 C 14.670487 11.782018 24.657577 0.185848 C 15.055957 10.667472 25.350995 -0.210220 C 15.783290 10.777079 26.501884 0.102787 C 13.890829 11.745388 23.358140 -0.227767 C 16.842020 5.272138 24.500952 0.320944 C 16.238526 6.358128 23.858589 -0.227066 C 16.707715 7.626991 23.993869 -0.077553 C 17.815283 7.889185 24.796607 -0.130869 C 18.406568 6.839827 25.440412 -0.087139 C 17.963542 5.532601 25.317536 -0.165628 C 18.687386 4.474589 26.067488 0.453256 C 18.849599 1.079898 26.188346 0.473574 C 28.358961 28.759222 26.718216 -0.309156 C 29.405480 28.258486 25.621555 -0.152176 C 30.087464 27.004044 26.127196 -0.165050 C 31.210728 26.807903 25.694531 -0.118971 C 31.945038 25.449334 26.308915 -0.463120 C 18.082145 2.610962 21.693822 0.110044 C 18.955988 2.644134 20.629755 -0.206926 C 20.299022 2.543179 20.846664 0.177846 C 20.714143 2.482315 22.170330 -0.213405 C 19.807160 2.473084 23.181036 0.094911 C 21.254842 2.518086 19.651643 -0.225788 C 23.018236 2.363182 26.535920 0.316936 C 23.825800 2.358857 25.394550 -0.241984 C 24.999647 1.648998 25.366571 -0.062876 C 25.442675 0.912023 26.463521 -0.132826 C 24.624647 0.861256 27.564797 -0.083505 C 23.424637 1.568231 27.645850 -0.162017 C 13.868133 1.385106 -0.015576 0.459318 C 10.950088 2.501380 1.355107 0.482232 C 9.996012 2.357445 2.510899 -0.290252 C 9.893104 3.635826 3.332386 -0.155689 C 11.190789 3.999264 4.044264 -0.178697 C 11.075673 5.214475 4.938727 -0.117566 C 12.390800 5.556279 5.625510 -0.449095 C 21.544369 28.028887 23.856282 0.319757 C 20.750758 27.284415 22.970472 -0.229204 C 20.974014 27.329703 21.622000 -0.067896 C 21.968207 28.117154 21.080303 -0.130225 C 14.046068 -0.017912 21.931499 -0.084583 C 22.580423 28.799320 23.318912 -0.175164 C 14.768169 0.772420 24.134053 0.459203 C 15.068174 1.879750 27.346446 0.486319 C 15.751901 2.860168 28.255331 -0.292607 C 14.823986 4.041632 28.571465 -0.154391 C 14.541424 4.913310 27.384232 -0.176199 C 13.644905 6.113235 27.656522 -0.109391 C 13.397226 6.988951 26.453137 -0.440977 C 6.976818 1.389410 16.843071 0.095249 C 6.272163 1.420560 18.038957 -0.217330 C 23.391486 2.640099 18.608921 0.188053 C 23.776953 3.754645 17.915503 -0.211318 C 7.062283 3.645038 16.764614 0.104123 C 22.611830 2.676729 19.908358 -0.229528 C 22.402501 24.500954 9.149999 0.321192 C 23.005993 23.858592 8.064010 -0.223820 C 22.536802 23.993873 6.795148 -0.079823 C 21.429234 24.796612 6.532953 -0.131578 C 20.837951 25.440417 7.582310 -0.085529 C 21.280979 25.317538 8.889535 -0.168709 C 20.557137 26.067490 9.947545 0.458072 C 20.394930 26.188343 13.342234 0.477658 C 19.606553 26.718212 14.507257 -0.309078 C 18.560034 25.621549 15.007994 -0.153106 C 17.878053 26.127189 16.262434 -0.163148 C 16.754789 25.694524 16.458576 -0.119744 C 16.020482 26.308906 17.817144 -0.462947 C 21.162379 21.693819 11.811177 0.112122 C 20.288536 20.629751 11.778006 -0.207258 C 18.945502 20.846660 11.878961 0.176838 C 18.530381 22.170327 11.939823 -0.214882 C 19.437365 23.181033 11.949053 0.096575 C 17.989681 19.651639 11.904056 -0.223367 C 16.226291 26.535919 12.058950 0.317690 C 15.418727 25.394548 12.063277 -0.242705 C 14.244881 25.366568 12.773136 -0.063027 C 13.801854 26.463518 13.510108 -0.132024 C 14.619884 27.564795 13.560874 -0.081636 C 15.819892 27.645848 12.853900 -0.167348 C 7.934381 -0.015593 13.037061 0.462519 C 10.852425 1.355092 11.920786 0.484061 C 11.806502 2.510885 12.064719 -0.290515 C 11.909408 3.332373 10.786338 -0.157565 C 10.611722 4.044252 10.422899 -0.177646 C 10.726838 4.938717 9.207688 -0.119063 C 9.411710 5.625502 8.865882 -0.451313 C 26.421145 23.856275 15.237595 0.320548 C 27.214757 22.970464 15.982067 -0.228740 C 26.991500 21.621991 15.936782 -0.071589 C 25.997306 21.080295 15.149332 -0.128421 C 25.198461 21.931493 14.440049 -0.084915 C 25.385090 23.318906 14.467163 -0.175097 C 24.476360 24.134048 13.649715 0.460486 C 24.176354 27.346444 12.542381 0.484387 C 23.492626 28.255331 11.561962 -0.292564 C 24.420539 28.571467 10.380498 -0.156142 C 24.703099 27.384235 9.508822 -0.176783 C 25.599617 27.656527 8.308898 -0.111903 C 25.847293 26.453142 7.433184 -0.439025 C 14.825705 16.843063 13.032735 0.094283 C 15.530361 18.038950 13.001583 -0.216245 C 15.853036 18.608916 11.782044 0.187694 C 15.467567 17.915499 10.667499 -0.209611 C 14.740237 16.764609 10.777108 0.103161 C 16.632693 19.908354 11.745412 -0.229201 C 13.681500 18.765549 5.272167 0.319986 C 14.284994 19.407911 6.358156 -0.223554 C 13.815806 19.272630 7.627018 -0.078484 C 12.708239 18.469891 7.889213 -0.132747 C 12.116955 17.826086 6.839856 -0.085763 C 12.559980 17.948965 5.532631 -0.169850 C 11.836136 17.199013 4.474621 0.455771 C 11.673922 17.078160 1.079932 0.477060 C 19.606575 16.548253 28.759241 -0.307491 C 18.560054 17.644916 28.258504 -0.153411 C 17.878071 17.139276 27.004064 -0.162636 C 16.754806 17.571941 26.807922 -0.117235 C 16.020496 16.957559 25.449354 -0.465533 C 12.441369 21.572684 2.610989 0.109134 C 11.567524 22.636752 2.644160 -0.205203 C 10.224490 22.419843 2.543205 0.176161 C 9.809371 21.096176 2.482343 -0.214635 C 10.716356 20.085470 2.473113 0.095496 C 9.268668 23.614864 2.518110 -0.223594 C 7.505285 16.730584 2.363216 0.317322 C 6.697720 17.871955 2.358889 -0.242366 C 22.965873 17.899935 1.649030 -0.063779 C 22.522846 16.802985 0.912058 -0.131189 C 5.898876 15.701708 0.861292 -0.085139 C 7.098887 15.620655 1.568266 -0.163964 C 7.934359 14.437748 1.385105 0.458405 C 10.852408 13.067063 2.501380 0.484044 C 11.806485 11.911270 2.357447 -0.291363 C 11.909395 11.089782 3.635828 -0.157517 C 10.611711 10.377903 3.999267 -0.177764 C 10.726830 9.483438 5.214478 -0.118461 C 9.411704 8.796653 5.556284 -0.449370 C 26.421162 19.410190 28.028903 0.322177 C 27.214772 20.296001 27.284431 -0.231091 C 26.991514 21.644474 27.329716 -0.066516 C 25.997320 22.186170 28.117166 -0.130646 C 16.477445 21.335010 -0.017883 -0.085002 C 25.385108 19.947559 28.799335 -0.178569 C 15.755348 19.132455 0.772451 0.461349 C 15.455349 15.920059 1.879785 0.485580 C 14.771624 15.011172 2.860204 -0.291763 C 15.699540 14.695036 4.041668 -0.157037 C 15.982101 15.882268 4.913344 -0.174369 C 16.878621 15.609976 6.113268 -0.111118 C 17.126298 16.813361 6.988982 -0.439139 C 23.546686 26.423440 1.389431 0.093387 C 24.251344 25.227553 1.420583 -0.214521 C 24.574022 24.657587 2.640122 0.185851 C 24.188555 25.351004 3.754667 -0.210126 C 23.461223 26.501894 3.645058 0.103644 C 7.911680 23.358149 2.676754 -0.226449 C 9.321005 19.694331 10.078786 0.320920 C 9.924497 20.780321 9.436423 -0.225359 C 26.897306 22.049184 9.571703 -0.077463 C 25.789740 22.311378 10.374441 -0.132240 C 25.198457 21.262020 11.018246 -0.083234 C 25.641485 19.954794 10.895370 -0.169961 C 24.917643 18.896782 11.645322 0.455024 C 24.755435 15.502091 11.766180 0.478485 C 23.967058 14.337067 12.296050 -0.308828 C 22.920537 13.836331 11.199389 -0.152069 C 22.238556 12.581889 11.705030 -0.162082 C 21.115291 12.385748 11.272365 -0.119204 C 20.380984 11.027179 11.886749 -0.464398 C 8.080877 17.033155 7.271656 0.110395 C 7.207031 17.066327 6.207589 -0.205861 C 23.305998 16.965372 6.424498 0.176159 C 22.890880 16.904508 7.748164 -0.213585 C 23.797865 16.895277 8.758870 0.095534 C 22.350175 16.940279 5.229477 -0.223153 C 20.586797 16.785375 12.113754 0.318042 C 19.779231 16.781050 10.972384 -0.244329 C 18.605384 16.071191 10.944405 -0.062672 C 18.162359 15.334216 12.041355 -0.130200 C 18.980390 15.283449 13.142631 -0.084297 C 20.180400 15.990424 13.223684 -0.165274 C 21.015873 15.807261 14.406590 0.460733 C 23.933920 16.923535 15.777273 0.482622 C 24.887999 16.779600 16.933065 -0.290759 C 24.990907 18.057981 17.754552 -0.156910 C 23.693223 18.421419 18.466430 -0.179901 C 23.808341 19.636630 19.360893 -0.117775 C 22.493214 19.978434 20.047676 -0.449853 C 13.339644 13.606732 9.434116 0.321143 C 14.133255 12.862260 8.548306 -0.229374 C 13.909996 12.907548 7.199834 -0.068843 C 12.915801 13.694999 6.658137 -0.128602 C 12.116958 14.404281 7.509333 -0.085016 C 12.303589 14.377165 8.896746 -0.177125 C 11.394861 15.194613 9.711887 0.458782 C 11.094861 16.301943 12.924280 0.485115 C 10.411135 17.282361 13.833165 -0.294102 C 11.339050 18.463825 14.149299 -0.154491 C 11.621608 19.335503 12.962066 -0.176293 C 12.518126 20.535428 13.234356 -0.112006 C 12.765801 21.411144 12.030971 -0.440358 C 19.186193 15.811603 2.420905 0.089639 C 19.890852 15.842753 3.616791 -0.214634 C 20.213529 17.062292 4.186755 0.185926 C 19.828059 18.176838 3.493337 -0.210223 C 19.100726 18.067231 2.342448 0.102684 C 20.993187 17.098922 5.486192 -0.227762 C 18.041996 23.572172 4.343380 0.320986 C 18.645490 22.486182 4.985743 -0.227003 C 18.176301 21.217319 4.850463 -0.077674 C 17.068733 20.955125 4.047725 -0.131125 C 16.477448 22.004483 3.403920 -0.087284 C 16.920474 23.311709 3.526796 -0.165572 C 16.196630 24.369721 2.776844 0.453207 C 16.034417 27.764412 2.655986 0.473615 C 6.525055 0.085088 2.126116 -0.309163 C 5.478536 0.585824 3.222777 -0.152171 C 4.796552 1.840266 2.717136 -0.165051 C 3.673288 2.036407 3.149801 -0.118986 C 2.938978 3.394976 2.535417 -0.463091 C 16.801871 26.233348 7.150510 0.110043 C 15.928028 26.200176 8.214577 -0.206925 C 14.584994 26.301131 7.997668 0.177840 C 14.169873 26.361995 6.674002 -0.213443 C 15.076856 26.371226 5.663296 0.094881 C 13.629174 26.326224 9.192689 -0.225797 C 11.865780 26.481128 2.308412 0.316892 C 11.058216 26.485453 3.449782 -0.242087 C 9.884369 27.195312 3.477761 -0.062911 C 9.441341 27.932287 2.380811 -0.132801 C 10.259369 27.983054 1.279535 -0.083451 C 11.459379 27.276079 1.198482 -0.162000 C 12.294850 27.459242 0.015576 0.459285 C 23.933928 26.342930 27.489225 0.482239 C 24.888004 26.486865 26.333433 -0.290253 C 24.990912 25.208484 25.511946 -0.155689 C 23.693227 24.845046 24.800068 -0.178707 C 23.808343 23.629835 23.905605 -0.117569 C 22.493216 23.288031 23.218822 -0.449085 C 13.339647 0.815423 4.988050 0.319756 C 14.133258 1.559895 5.873860 -0.229190 C 13.910002 1.514607 7.222332 -0.067886 C 12.915809 0.727156 7.764029 -0.130224 C 12.116965 0.017874 6.912833 -0.084594 C 12.303593 0.044990 5.525420 -0.175179 C 20.115847 28.071890 4.710279 0.459205 C 19.815842 26.964560 1.497886 0.486308 C 19.132115 25.984142 0.589001 -0.292594 C 20.060030 24.802678 0.272867 -0.154392 C 20.342592 23.931000 1.460100 -0.176205 C 21.239111 22.731075 1.187810 -0.109392 C 21.486790 21.855359 2.391195 -0.440993 C 27.907198 27.454900 12.001261 0.095283 C 28.611853 27.423750 10.805375 -0.217315 C 11.492530 26.204211 10.235411 0.188032 C 11.107063 25.089665 10.928829 -0.211357 C 27.821733 25.199272 12.079718 0.104118 C 12.272186 26.167581 8.935974 -0.229524 N 13.957630 2.942677 17.641770 -0.316444 N 14.761182 2.250126 16.708656 -0.329921 N 14.128036 5.888551 16.952679 -0.237117 N 25.800208 28.753755 16.460306 -0.322418 N 25.072877 27.572003 16.160614 -0.311110 N 10.173585 3.419766 15.303649 -0.314342 N 11.018477 2.736154 16.204746 -0.316957 N 20.457734 12.631783 16.917489 -0.222714 N 22.678634 11.479440 25.624728 -0.311234 N 23.482188 12.171991 26.557842 -0.331571 N 22.849045 8.533566 26.313819 -0.236082 N 25.800229 14.512710 26.806192 -0.320870 N 25.072897 15.694462 27.105884 -0.311674 N 18.894595 11.002351 27.962849 -0.312655 N 19.739484 11.685963 27.061752 -0.319864 N 11.736751 1.790334 26.349009 -0.222125 N 9.597125 11.202545 17.364865 -0.314025 N 10.400677 12.135661 16.672312 -0.330115 N 9.767536 11.891633 20.310736 -0.236790 N 12.718715 12.384013 14.331595 -0.320703 N 11.991383 12.683708 13.149843 -0.311459 N 23.255082 13.540667 17.841950 -0.314575 N 24.099972 12.639571 17.158339 -0.316943 N 16.097246 11.926814 27.053964 -0.220853 N 18.318139 3.219572 25.901633 -0.312733 N 19.121694 2.286456 26.594186 -0.328855 N 18.488545 2.530484 22.955762 -0.236780 N 12.718705 2.038142 0.090571 -0.321407 N 11.991375 1.738447 1.272323 -0.309635 N 14.534098 0.881450 25.424548 -0.314056 N 15.378989 1.782546 26.108159 -0.318518 N 7.376239 2.495303 16.212534 -0.222468 N 20.926386 25.901633 11.202562 -0.316442 N 20.122834 26.594184 12.135676 -0.329908 N 20.755980 22.955759 11.891653 -0.237108 N 9.083808 0.090555 12.384026 -0.322419 N 9.811139 1.272307 12.683718 -0.311085 N 24.710431 25.424544 13.540683 -0.314340 N 23.865539 26.108156 12.639586 -0.316989 N 14.426282 16.212527 11.926843 -0.222708 N 12.205382 17.364870 3.219604 -0.311238 N 11.401828 16.672319 2.286490 -0.331230 N 12.034971 20.310744 2.530513 -0.236245 N 9.083787 14.331600 2.038140 -0.318906 N 9.811119 13.149848 1.738448 -0.312689 N 15.989421 17.841959 0.881483 -0.313593 N 15.144532 17.158347 1.782580 -0.319127 N 23.147265 27.053976 2.495323 -0.222060 N 25.286891 17.641765 11.479467 -0.314053 N 24.483339 16.708649 12.172020 -0.330077 N 7.674480 16.952677 8.533596 -0.236692 N 22.165301 16.460297 14.512737 -0.320717 N 22.892633 16.160602 15.694489 -0.311356 N 11.628934 15.303643 11.002382 -0.314532 N 10.784044 16.204739 11.685993 -0.317001 N 18.786770 16.917496 1.790368 -0.220050 N 16.565877 25.624738 2.942699 -0.312706 N 15.762322 26.557854 2.250146 -0.328812 N 16.395471 26.313826 5.888570 -0.236816 N 22.165311 26.806168 28.753761 -0.321401 N 22.892641 27.105863 27.572009 -0.309570 N 20.349918 27.962860 3.419784 -0.314060 N 19.505027 27.061764 2.736173 -0.318585 N 27.507777 26.349007 12.631798 -0.222447 O 11.949882 4.546710 18.490659 -0.481575 O 15.302934 2.017060 19.222151 -0.455903 O 13.584717 3.559949 15.248268 -0.482021 O 17.570392 2.333773 17.545142 -0.497241 O 27.343301 27.937173 15.004533 -0.461931 O 23.763159 28.385988 17.852622 -0.493877 O 8.163741 3.698981 13.521069 -0.486160 O 11.378653 5.264361 15.816213 -0.459040 O 9.744165 0.967996 15.591515 -0.506508 O 20.670886 9.875407 24.775839 -0.481904 O 24.023933 12.405057 24.044347 -0.456307 O 22.305727 10.862168 28.018230 -0.482440 O 26.291395 12.088344 25.721356 -0.498201 O 27.343323 15.329292 28.261965 -0.462526 O 23.763176 14.880477 25.413876 -0.494288 O 8.163723 10.723174 0.901097 -0.485104 O 20.099664 9.157756 27.450285 -0.455521 O 18.465171 13.454121 27.674983 -0.504243 O 25.031379 10.353654 18.968898 -0.481546 O 10.942426 9.622164 16.439250 -0.455107 O 26.666214 13.596048 17.982133 -0.483043 O 13.209886 11.299174 16.755961 -0.497461 O 14.261807 13.839789 13.515012 -0.461246 O 10.681665 10.991697 13.963830 -0.492982 O 21.245240 15.323248 18.121163 -0.486175 O 24.460152 13.028101 19.686545 -0.457051 O 22.825658 13.252804 15.390182 -0.507656 O 16.310388 4.068463 24.297600 -0.482150 O 19.663441 4.799953 26.827248 -0.454306 O 17.945230 0.826069 25.284365 -0.480564 O 21.930902 3.122943 26.510537 -0.498296 O 14.261801 0.582366 0.907154 -0.461088 O 10.681654 3.430458 0.458336 -0.493219 O 21.245240 27.943217 25.145335 -0.485712 O 15.739164 1.394016 23.579953 -0.457751 O 14.104679 1.169313 27.876316 -0.508010 O 22.934134 24.297600 10.353673 -0.481615 O 19.581082 26.827250 9.622181 -0.455923 O 21.299299 25.284361 13.596064 -0.482007 O 17.313624 26.510537 11.299190 -0.497281 O 7.540715 0.907137 13.839799 -0.461910 O 11.120857 0.458322 10.991710 -0.493895 O 26.720275 25.145329 15.323263 -0.486149 O 23.505363 23.579949 13.028119 -0.459071 O 25.139851 27.876314 13.252817 -0.506495 O 14.213130 18.968903 4.068493 -0.481172 O 10.860083 16.439253 4.799985 -0.454054 O 12.578289 17.982142 0.826102 -0.481528 O 8.592621 16.755966 3.122976 -0.496105 O 7.540693 13.515018 0.582367 -0.457539 O 11.120840 13.963833 3.430456 -0.489695 O 26.720293 18.121136 27.943235 -0.486324 O 14.784352 19.686554 1.394047 -0.458178 O 16.418845 15.390189 1.169349 -0.507178 O 9.852637 18.490656 9.875434 -0.481781 O 23.941590 19.222146 12.405082 -0.455107 O 8.217802 15.248262 10.862199 -0.483101 O 21.674130 17.545136 12.088371 -0.497562 O 20.622209 15.004521 15.329320 -0.461198 O 24.202351 17.852613 14.880502 -0.493035 O 13.638776 13.521062 10.723169 -0.486125 O 10.423864 15.816209 9.157787 -0.457309 O 12.058358 15.591506 13.454150 -0.507578 O 18.573628 24.775847 4.546732 -0.482165 O 15.220575 24.044357 2.017084 -0.454447 O 16.938786 28.018241 3.559967 -0.480508 O 12.953114 25.721367 2.333795 -0.498422 O 20.622215 28.261944 27.937178 -0.461034 O 24.202362 25.413852 28.385996 -0.493291 O 13.638776 0.901093 3.698997 -0.485682 O 19.144852 27.450294 5.264379 -0.457766 O 20.779337 27.674997 0.968016 -0.507996 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 Mn 12.654101 4.142892 16.831245 0.941579 101.919568 0.19363600E+04 0.62962249E+05 18.924797 15.270247 0.437875 1.919101 0.997820 55.741842 160.507798 0.417133 0.451583 -1.095384 -0.055122 0.045446 -0.046180 0.085067 -0.125095 -0.040115 -0.000485 -0.000376 0.192247 -0.160857 0.049900 0.110957 23.064799 27.767420 -1.652433 4.219479 18.732845 2.636071 22.694131 3.661426 2 Mn 16.270092 1.027701 17.816279 0.955545 147.244091 0.30763190E+04 0.11066778E+06 21.016263 16.892865 0.330986 1.887432 0.999220 55.557107 160.401771 0.489452 0.347862 -1.186492 -0.031714 0.029581 0.092049 0.101754 0.068858 -0.010215 0.017373 -0.033821 0.178151 -0.102771 0.038857 0.063914 25.469473 26.681236 -2.111002 -6.780217 27.990474 8.740973 21.736709 3.722456 3 Mn 8.843109 2.261666 14.477259 0.932097 107.772262 0.20825788E+04 0.68833090E+05 19.503416 15.742569 0.437900 1.914822 0.998058 56.111087 161.917634 0.415269 0.446253 -1.100671 -0.048667 -0.059288 -0.037773 0.085501 0.008107 0.111452 -0.055139 -0.043389 -0.159450 -0.151313 0.044913 0.106400 24.462148 18.959065 1.306400 1.675707 29.532774 7.679102 24.894605 3.676873 4 Mn 21.374934 10.279225 26.435253 0.939281 102.017930 0.19387282E+04 0.63058180E+05 18.935434 15.278652 0.439999 1.919336 0.997850 55.774150 160.622121 0.417059 0.451528 -1.095423 -0.056119 -0.042686 0.044522 0.083389 0.123686 0.041217 0.000887 -0.000911 0.191035 -0.159247 0.047693 0.111554 23.078703 27.782131 1.646210 -4.221714 18.744521 2.643907 22.709456 3.654311 5 Mn 24.991093 13.394416 25.450219 0.955402 147.338172 0.30786217E+04 0.11077446E+06 21.026281 16.900217 0.328803 1.886697 0.999222 55.576307 160.489289 0.489287 0.347904 -1.186422 -0.031954 -0.029742 -0.091358 0.101251 -0.069360 0.009947 0.018089 -0.033673 0.180297 -0.103635 0.038617 0.065017 25.481726 26.691681 2.104012 6.778858 28.008076 8.744515 21.745421 3.720755 6 Mn 17.564120 12.160451 28.789239 0.928243 108.052040 0.20898150E+04 0.69129916E+05 19.530825 15.765704 0.444119 1.915784 0.998045 56.207188 162.245251 0.415143 0.446016 -1.100853 -0.048100 0.058401 0.038230 0.084769 -0.006937 -0.112630 -0.055820 -0.045574 -0.162195 -0.152991 0.044772 0.108219 24.495531 18.984902 -1.298370 -1.667263 29.565274 7.690236 24.936416 -3.955047 7 Mn 25.735511 12.013070 18.565366 0.943439 101.819314 0.19341280E+04 0.62863724E+05 18.905098 15.255848 0.446228 1.921877 0.997825 55.666721 160.193303 0.417611 0.451252 -1.095721 -0.055052 0.045762 0.044729 0.084413 0.040696 -0.125617 0.000187 -0.096331 -0.099450 -0.161711 0.049756 0.111955 23.039877 27.731357 -4.212643 -1.641988 22.673867 -2.636732 18.714408 3.662628 8 Mn 11.909670 11.027751 15.449890 0.954487 147.437828 0.30816778E+04 0.11091143E+06 21.034909 16.908399 0.332217 1.887349 0.999219 55.600011 160.574909 0.489179 0.347896 -1.186434 -0.031614 -0.092280 0.029809 0.101998 0.009442 0.068416 -0.017186 -0.106354 -0.038985 -0.102309 0.038138 0.064171 25.490789 26.705544 6.781301 -2.107144 21.753966 -8.747662 28.012858 3.721483 9 Mn 21.924605 14.367059 16.683850 0.933240 107.705441 0.20808471E+04 0.68756074E+05 19.490744 15.732329 0.439765 1.915695 0.997995 56.063581 161.715179 0.415583 0.446043 -1.100888 -0.047912 0.036840 -0.058906 0.084396 -0.111600 0.008150 0.054298 0.059285 0.143989 -0.151211 0.045157 0.106055 24.445589 18.947040 -1.674806 1.303657 24.877988 -7.668918 29.511740 3.668922 10 Mn 17.014523 2.409047 24.701132 0.942736 101.876735 0.19353826E+04 0.62921460E+05 18.918676 15.265888 0.436881 1.918923 0.997824 55.718527 160.420306 0.417220 0.451553 -1.095421 -0.055991 -0.045707 -0.045055 0.085171 -0.040707 0.125617 -0.000092 -0.094530 -0.096264 -0.160991 0.048804 0.112186 23.057279 27.755973 4.215185 1.645784 22.688023 -2.639773 18.727841 3.656699 11 Mn 20.630515 3.394366 27.816608 0.954845 147.367976 0.30802376E+04 0.11084583E+06 21.028622 16.904914 0.332468 1.887564 0.999214 55.584795 160.517147 0.489213 0.347915 -1.186427 -0.031455 0.092302 -0.029657 0.101925 -0.010537 -0.069442 -0.018213 -0.106146 -0.042383 -0.103665 0.038736 0.064930 25.480845 26.692464 -6.776512 2.103836 21.745712 -8.741914 28.004360 3.726638 12 Mn 13.203624 0.055058 26.582648 0.932067 107.799241 0.20832525E+04 0.68858348E+05 19.503702 15.743054 0.440842 1.915625 0.998035 56.106747 161.888853 0.415359 0.446136 -1.100784 -0.047661 -0.036881 0.059867 0.084947 0.111759 -0.007866 0.054390 0.058409 0.143023 -0.151050 0.044613 0.106437 24.461743 18.957813 1.676910 -1.303849 24.893848 -7.676588 29.533569 3.678094 13 Mn 22.229915 24.701418 12.013087 0.941570 101.919448 0.19363473E+04 0.62961801E+05 18.924863 15.270255 0.437839 1.919088 0.997820 55.742054 160.508932 0.417130 0.451586 -1.095381 0.055128 -0.045440 0.046178 0.085066 -0.125101 -0.040127 -0.000498 -0.000393 0.192335 -0.160881 0.049923 0.110958 23.064936 27.767453 -1.652306 4.219562 18.732804 2.636073 22.694551 3.661613 14 Mn 18.613924 27.816609 11.028053 0.955505 147.249184 0.30764286E+04 0.11067280E+06 21.016746 16.893163 0.330954 1.887414 0.999220 55.558198 160.406152 0.489447 0.347862 -1.186491 0.031725 -0.029588 -0.092038 0.101749 0.068863 -0.010236 0.017369 -0.033797 0.178134 -0.102773 0.038872 0.063902 25.470159 26.681992 -2.111017 -6.780458 27.991224 8.741293 21.737261 3.722453 15 Mn 26.040907 26.582644 14.367073 0.932100 107.772357 0.20825805E+04 0.68833142E+05 19.503412 15.742564 0.437906 1.914825 0.998058 56.110971 161.917167 0.415269 0.446252 -1.100672 0.048658 0.059288 0.037783 0.085500 0.008110 0.111453 -0.055154 -0.043369 -0.159473 -0.151321 0.044912 0.106409 24.462137 18.959133 1.306470 1.675723 29.532648 7.679135 24.894629 3.676924 16 Mn 13.509082 18.565085 2.409079 0.941702 101.934290 0.19366943E+04 0.62972855E+05 18.923632 15.269341 0.438525 1.919343 0.997838 55.723805 160.430695 0.417256 0.451451 -1.095516 0.056330 0.044141 -0.045249 0.084670 0.124313 0.040800 0.000468 0.000989 0.191695 -0.159938 0.048409 0.111529 23.064262 27.765914 1.647022 -4.222661 18.731588 2.639179 22.695285 3.655526 17 Mn 9.892923 15.449894 3.394113 0.952877 147.452999 0.30828075E+04 0.11095213E+06 21.026564 16.903723 0.335085 1.888205 0.999221 55.627817 160.607368 0.489629 0.347576 -1.186816 0.031267 0.030301 0.092891 0.102589 -0.069767 0.010634 0.017487 -0.031509 0.177951 -0.103458 0.039654 0.063803 25.478689 26.689458 2.107121 6.775242 28.002606 8.741848 21.744004 3.678158 18 Mn 17.319896 16.683859 0.055093 0.932197 107.796787 0.20829659E+04 0.68851613E+05 19.509200 15.746092 0.437651 1.914608 0.998028 56.122651 161.977182 0.415126 0.446370 -1.100559 0.049001 -0.059189 -0.037243 0.085390 -0.007959 -0.112014 -0.054613 -0.042457 -0.159954 -0.151526 0.044846 0.106680 24.471203 18.963335 -1.304578 -1.674331 29.544924 7.681726 24.905349 3.670128 19 Mn 9.148505 16.831240 10.278966 0.943354 101.817560 0.19340315E+04 0.62860426E+05 18.905592 15.255986 0.445991 1.921788 0.997827 55.669222 160.205516 0.417584 0.451282 -1.095692 0.055078 -0.045763 -0.044684 0.084407 0.040671 -0.125622 0.000235 -0.096490 -0.099591 -0.161769 0.049862 0.111906 23.040735 27.732015 -4.213016 -1.642252 22.675861 -2.636837 18.714330 3.663215 20 Mn 22.974346 17.816559 13.394442 0.954469 147.438578 0.30816714E+04 0.11091122E+06 21.035019 16.908413 0.332172 1.887335 0.999219 55.600020 160.575290 0.489177 0.347897 -1.186433 0.031608 0.092291 -0.029809 0.102007 0.009427 0.068396 -0.017157 -0.106327 -0.039101 -0.102277 0.038120 0.064158 25.490976 26.705923 6.781317 -2.106697 21.753990 -8.747698 28.013014 3.721651 21 Mn 12.959411 14.477251 12.160482 0.933286 107.704632 0.20808372E+04 0.68755528E+05 19.490536 15.732206 0.439778 1.915707 0.997995 56.062357 161.710338 0.415589 0.446039 -1.100893 0.047897 -0.036869 0.058900 0.084396 -0.111612 0.008140 0.054363 0.059363 0.143974 -0.151252 0.045143 0.106109 24.445371 18.947094 -1.674621 1.303826 24.878137 -7.669421 29.510881 3.669224 22 Mn 17.869493 26.435263 4.143200 0.942739 101.876218 0.19353690E+04 0.62920937E+05 18.918663 15.265871 0.436840 1.918911 0.997825 55.718293 160.419786 0.417219 0.451555 -1.095419 0.055998 0.045702 0.045060 0.085176 -0.040741 0.125647 -0.000088 -0.094607 -0.096296 -0.161049 0.048824 0.112224 23.057314 27.755927 4.215534 1.645544 22.688097 -2.639549 18.727918 3.657086 23 Mn 14.253501 25.449944 1.027724 0.954600 147.406710 0.30811415E+04 0.11088717E+06 21.032280 16.907400 0.332250 1.887429 0.999215 55.593328 160.551385 0.489174 0.347915 -1.186419 0.031552 -0.092179 0.029715 0.101860 -0.010701 -0.069495 -0.018231 -0.106072 -0.042303 -0.103725 0.038856 0.064869 25.485853 26.697550 -6.779056 2.104765 21.750277 -8.743899 28.009732 3.726540 24 Mn 21.680392 28.789252 2.261684 0.932069 107.800010 0.20832828E+04 0.68859520E+05 19.503696 15.743107 0.440858 1.915630 0.998035 56.106530 161.887792 0.415362 0.446133 -1.100788 0.047640 0.036905 -0.059871 0.084948 0.111763 -0.007870 0.054422 0.058457 0.142969 -0.151066 0.044605 0.106461 24.461646 18.957902 1.677272 -1.304136 24.893512 -7.676641 29.533524 3.678190 25 H 11.117551 5.535203 20.626582 0.125314 1.144819 0.84664196E+01 0.84019359E+02 1.784768 1.682818 -1.100693 2.355811 0.997080 3.500810 9.745955 0.492063 1.254312 -0.714895 -0.025680 0.019106 -0.003643 0.032214 -0.012998 -0.002237 0.006495 0.004017 0.023497 -0.017570 0.002897 0.014673 1.836923 2.095366 -0.520233 0.207908 1.800034 -0.142172 1.615368 0.000215 26 H 11.916397 5.307330 22.763947 0.093642 1.244048 0.90208760E+01 0.90033368E+02 1.815475 1.682990 -0.887959 2.438312 0.998503 3.479019 9.395903 0.521202 1.177458 -0.733701 -0.016088 0.019434 0.026357 0.036485 -0.016335 0.002281 0.004264 0.009875 0.019933 -0.021209 0.007389 0.013820 1.885422 1.681005 -0.199802 -0.380037 1.643489 0.379309 2.331772 -0.000153 27 H 13.789669 3.951645 23.196612 0.111506 1.066443 0.73981168E+01 0.71868533E+02 1.778618 1.628263 -1.017360 2.388699 0.997276 3.667353 10.518648 0.469169 1.343876 -0.694019 0.017222 -0.003952 0.036060 0.040156 -0.014398 0.003457 0.001809 -0.000543 0.041017 -0.021633 0.007376 0.014256 1.906173 1.689553 -0.022229 0.427077 1.426746 -0.040290 2.602222 0.000240 28 H 14.796071 2.846909 21.434223 0.104367 1.056450 0.76844380E+01 0.75951069E+02 1.807382 1.688711 -1.418416 2.196152 0.992311 3.994675 11.854580 0.445302 1.391649 -0.682648 0.028956 -0.020921 0.010550 0.037248 -0.008095 0.005692 -0.000726 0.009480 0.002425 -0.010288 -0.001340 0.011628 1.878118 2.104829 -0.420806 0.221329 1.758189 -0.118584 1.771337 -0.000042 29 H 15.760607 1.306630 14.609654 0.128438 1.006339 0.79135364E+01 0.78993422E+02 1.773184 1.730353 -1.463749 2.179965 0.991746 4.013525 12.069859 0.432470 1.418829 -0.677623 0.016125 -0.023538 0.006937 0.029362 0.000949 -0.001895 -0.007362 0.001304 -0.029491 -0.013076 0.004706 0.008371 1.810617 1.710413 -0.383941 0.034459 2.091950 -0.045225 1.629490 -0.000434 30 H 14.663504 1.892171 13.597218 0.131531 0.955950 0.70703537E+01 0.67686618E+02 1.640316 1.578331 -0.903267 2.445301 0.997491 3.525414 9.929994 0.484237 1.321253 -0.699279 -0.011842 -0.003080 -0.017891 0.021675 0.004997 0.001094 -0.002981 0.003109 0.002227 -0.006841 0.001753 0.005088 1.697777 1.722520 0.103266 0.348530 1.443614 0.284709 1.927197 0.000406 31 H 16.997244 3.392076 14.543312 0.091984 1.126635 0.93004121E+01 0.95174862E+02 1.808450 1.795866 -1.082283 2.345582 0.994547 3.875581 11.218099 0.460266 1.300401 -0.703371 0.021938 -0.002406 0.017295 0.028039 0.002770 0.001761 0.001648 0.004326 0.025195 -0.007746 -0.001233 0.008979 1.809063 1.922170 0.071923 0.352920 1.487058 0.186322 2.017962 -0.000091 32 H 15.854791 4.072804 13.643369 0.097993 1.283712 0.10651293E+02 0.11038516E+03 1.842557 1.822157 -0.716079 2.513799 0.999329 3.504787 9.523942 0.505589 1.168962 -0.737888 -0.019032 0.021462 -0.013895 0.031873 -0.007882 -0.000604 -0.008472 -0.002010 -0.007512 -0.011630 -0.000393 0.012023 1.834785 1.806440 -0.410933 -0.020010 2.128881 -0.000907 1.569035 0.000065 33 H 16.442585 2.947877 11.803101 0.086960 1.235852 0.99577948E+01 0.10136949E+03 1.785542 1.749629 -0.674553 2.525302 0.999684 3.485128 9.354211 0.521918 1.152816 -0.741233 0.002966 0.019834 -0.017257 0.026458 -0.001093 -0.003073 -0.006549 0.002382 -0.001688 -0.008188 0.001880 0.006307 1.784366 1.881853 -0.068748 0.392285 1.458927 -0.037136 2.012317 0.000009 34 H 17.056545 1.727760 12.630933 0.098291 0.976027 0.74484861E+01 0.72683344E+02 1.698715 1.647691 -1.129245 2.336665 0.993962 3.806130 11.041456 0.459224 1.366832 -0.689159 0.017205 -0.019729 0.008621 0.027560 -0.002913 -0.002446 -0.001996 0.003211 -0.007880 -0.005364 0.000532 0.004832 1.727953 1.456992 0.078686 -0.086901 2.289175 0.108928 1.437691 0.000087 35 H 18.080389 4.136263 12.304992 0.081824 1.328839 0.10679460E+02 0.10963028E+03 1.808381 1.758868 -0.822533 2.454028 0.998942 3.476156 9.094378 0.549258 1.086297 -0.759219 -0.022155 0.014730 -0.005183 0.027105 -0.006635 -0.002880 -0.002023 0.007669 -0.002203 -0.008612 0.000318 0.008293 1.799580 1.505589 0.132253 -0.060031 2.432091 -0.083789 1.461061 0.000019 36 H 18.690861 2.942106 13.176091 0.083697 1.189509 0.95802127E+01 0.98376275E+02 1.843921 1.794845 -1.141855 2.311464 0.995373 3.906142 11.180202 0.473021 1.260986 -0.711622 -0.001821 -0.019334 0.022505 0.029725 0.000605 -0.001691 -0.004995 0.003751 0.013860 -0.006445 -0.000846 0.007290 1.840583 2.027671 -0.090278 0.489122 1.442611 -0.062145 2.051467 0.000044 37 H 18.247831 2.595978 10.268582 0.141878 1.158097 0.89928558E+01 0.88845120E+02 1.676640 1.637516 -0.930854 2.426805 0.999280 3.251805 8.473564 0.554454 1.118162 -0.750258 -0.012943 0.004773 -0.005525 0.014860 -0.003909 0.002360 0.000170 0.001233 0.003940 -0.005071 0.000729 0.004342 1.666168 1.690627 0.003877 0.343731 1.377020 0.005499 1.930856 -0.000005 38 H 19.672842 3.051718 10.833931 0.142145 1.142666 0.83665750E+01 0.80659360E+02 1.619032 1.543486 -0.960980 2.408738 0.999464 3.147067 7.932592 0.594990 1.067798 -0.763846 0.010510 0.013364 0.004678 0.017634 0.005298 0.002194 0.001262 -0.000970 -0.008972 -0.004452 -0.002927 0.007379 1.637580 1.981103 0.421658 -0.193512 1.563924 -0.077001 1.367713 0.000010 39 H 19.102490 1.595078 11.182948 0.137884 1.010118 0.75089274E+01 0.72419665E+02 1.648333 1.585916 -0.914349 2.438328 0.998453 3.456385 9.530896 0.505608 1.256070 -0.713610 0.002294 -0.014457 0.010853 0.018222 -0.006067 -0.000472 -0.004521 -0.011476 -0.003321 -0.008552 -0.001764 0.010315 1.651274 1.417845 -0.228230 -0.011697 2.200302 -0.023713 1.335675 0.000001 40 H 12.788490 7.326442 17.070076 0.094003 1.165009 0.80574208E+01 0.79953509E+02 1.887926 1.698294 -1.182686 2.313212 0.994611 3.770913 10.927460 0.459837 1.342335 -0.694289 -0.046063 0.009520 0.002640 0.047110 -0.001671 -0.003640 0.002605 0.007003 -0.038727 -0.013799 0.002744 0.011055 2.008085 2.967109 -0.192721 -0.015784 1.677706 0.011640 1.379441 0.000521 41 H 14.262338 9.100369 17.159493 0.125479 1.128265 0.79936387E+01 0.78977398E+02 1.819994 1.672230 -1.308104 2.259330 0.993846 3.730291 10.703876 0.472573 1.311833 -0.699933 -0.010690 0.031566 0.006375 0.033932 0.003843 -0.005594 0.004356 0.001425 -0.036234 -0.014975 0.004885 0.010090 1.909811 1.740966 -0.358396 0.000521 2.675341 0.026027 1.313125 0.000752 42 H 17.281549 6.472649 16.868165 0.118129 1.105385 0.81066361E+01 0.79271407E+02 1.709329 1.620275 -1.060405 2.369253 0.997492 3.466867 9.459636 0.515777 1.214417 -0.723503 0.030141 -0.009043 -0.000036 0.031468 -0.003217 -0.000417 0.000003 0.000499 -0.054115 -0.018045 0.005796 0.012249 1.743506 2.305637 -0.050363 -0.006155 1.674280 0.040871 1.250601 0.000409 43 H 15.757119 4.767949 16.847974 0.091016 1.110850 0.78179296E+01 0.77281918E+02 1.851159 1.689101 -1.213642 2.295771 0.993905 3.855650 11.288512 0.452761 1.368519 -0.688371 0.018857 -0.043901 -0.001210 0.047795 -0.005137 0.000357 0.000436 -0.000794 -0.042130 -0.014063 0.001889 0.012174 1.966792 1.620079 -0.238772 -0.033023 2.869821 0.153736 1.410478 0.000489 44 H 16.618752 9.818593 17.658500 0.113008 1.166059 0.94994710E+01 0.97303821E+02 1.830635 1.796780 -1.027966 2.374897 0.996445 3.724536 10.633832 0.469195 1.274447 -0.710006 0.000747 0.012280 0.027473 0.030102 -0.000018 0.000550 0.005841 0.012680 0.031632 -0.013059 0.001044 0.012015 1.838257 1.808653 -0.145573 -0.130054 1.998895 0.363339 1.707223 0.000129 45 H 16.772240 9.662835 16.077831 0.121813 1.238907 0.10393990E+02 0.10803643E+03 1.873346 1.858474 -0.770765 2.506714 0.998753 3.502941 9.819285 0.472886 1.246126 -0.719640 0.004605 0.009877 -0.027809 0.029869 -0.002934 0.000938 -0.004549 0.009714 0.026136 -0.010916 0.000840 0.010076 1.877499 1.811831 0.014404 0.106361 1.867445 -0.398782 1.953220 0.000074 46 H 19.198427 4.214136 17.274870 0.126252 1.097167 0.80912133E+01 0.79214475E+02 1.727986 1.641637 -0.850635 2.475225 0.999276 3.360553 9.224931 0.500891 1.249027 -0.717246 -0.009816 0.026592 0.017676 0.033406 0.004287 -0.009829 0.009730 -0.005595 -0.025458 -0.018834 0.007081 0.011753 1.765307 1.594498 -0.167717 -0.093520 2.069902 0.351916 1.631519 0.000140 47 H 21.164139 4.268942 16.083600 0.094686 1.159512 0.82046434E+01 0.80499274E+02 1.770467 1.631589 -0.932181 2.417985 0.998030 3.532396 9.665627 0.513075 1.216727 -0.722907 0.021793 0.030638 -0.003667 0.037777 0.007573 -0.015213 0.004088 -0.001629 -0.021845 -0.020685 0.005338 0.015347 1.874291 1.956670 0.624741 0.034562 2.295296 0.078521 1.370907 -0.000162 48 H 21.917633 2.394061 14.883675 0.117990 1.169233 0.82835768E+01 0.81679888E+02 1.811896 1.667027 -0.815091 2.492046 0.999114 3.415769 9.449478 0.493754 1.258052 -0.715041 0.037455 -0.000127 -0.018759 0.041890 0.006058 -0.014960 0.009851 -0.000492 -0.031359 -0.024093 0.009995 0.014098 1.913614 2.659455 0.061780 -0.413487 1.476411 0.072234 1.604977 0.000131 49 H 20.525762 0.542254 14.745223 0.109857 1.042901 0.74769640E+01 0.72312934E+02 1.707022 1.603713 -0.966833 2.414848 0.998038 3.527300 9.863526 0.490971 1.289909 -0.706154 0.014697 -0.030175 -0.024729 0.041691 -0.006122 -0.011509 0.007412 0.000813 -0.004848 -0.012056 -0.004834 0.016890 1.766620 1.676391 -0.149857 -0.168729 1.952077 0.506192 1.671393 0.000031 50 H 22.180995 26.678116 16.542224 0.128677 0.939404 0.67949813E+01 0.64134454E+02 1.598258 1.528678 -0.708945 2.533689 0.999337 3.407277 9.398085 0.503185 1.289660 -0.706518 -0.024114 0.003054 -0.000672 0.024316 -0.000666 0.000507 -0.003413 0.004059 -0.008502 -0.005313 0.001505 0.003807 1.642580 2.048847 -0.300706 0.255976 1.440002 -0.056429 1.438891 0.000555 51 H 23.384493 25.749328 16.040333 0.129394 1.050107 0.80646956E+01 0.80312206E+02 1.788071 1.719383 -1.209811 2.305466 0.993458 3.771257 11.068396 0.447429 1.374639 -0.687867 0.007504 -0.023513 -0.015798 0.029305 0.002062 -0.001034 0.003380 -0.015657 -0.000242 -0.008335 -0.000925 0.009260 1.854517 1.554412 -0.171113 -0.190501 1.820042 0.429739 2.189098 -0.000058 52 H 22.716467 26.106995 18.803620 0.092583 1.119255 0.86619425E+01 0.86743960E+02 1.773759 1.708479 -0.972228 2.393719 0.996687 3.770117 10.660311 0.484002 1.263674 -0.711163 0.000866 0.021368 0.020022 0.029296 -0.008277 0.001406 0.002991 -0.001605 0.010808 -0.010770 0.003704 0.007066 1.821148 1.465815 -0.245840 -0.217412 1.897982 0.419265 2.099646 0.000017 53 H 22.257742 24.837844 17.949828 0.099002 1.139372 0.89957821E+01 0.88720278E+02 1.646156 1.628796 -0.670463 2.533574 0.999700 3.296652 8.532318 0.561560 1.105925 -0.753690 -0.011710 -0.021966 -0.008425 0.026279 0.002712 0.005778 0.000249 -0.005148 -0.001058 -0.007609 0.001780 0.005829 1.626704 1.681102 0.281990 0.110250 1.762580 -0.001597 1.436431 0.000050 54 H 24.971718 25.478188 18.590172 0.092762 1.248207 0.10682953E+02 0.11140980E+03 1.844952 1.854469 -0.716488 2.511398 0.999064 3.599597 9.991144 0.486513 1.207200 -0.727938 0.014213 0.018997 0.010896 0.026108 0.003464 0.004749 -0.000053 -0.005049 -0.007988 -0.007238 0.000982 0.006256 1.814959 1.739226 0.304753 0.072993 2.070545 -0.042180 1.635106 0.000089 55 H 24.563574 24.255189 17.649847 0.097251 1.073560 0.84420703E+01 0.83924450E+02 1.726314 1.690780 -0.798207 2.479110 0.997696 3.638222 10.219482 0.485188 1.269862 -0.710938 0.001723 -0.018555 -0.018911 0.026549 -0.001827 0.002693 0.002010 -0.006380 0.010527 -0.006429 0.001469 0.004960 1.747744 1.406623 -0.218304 -0.221734 1.727136 0.312000 2.109474 -0.000043 56 H 23.862409 24.448442 20.410249 0.086955 1.151784 0.89607554E+01 0.89618348E+02 1.753164 1.697397 -0.626355 2.549677 0.999579 3.550884 9.717851 0.507926 1.205740 -0.726639 0.002423 0.019620 0.020767 0.028672 -0.003505 0.001311 0.003617 -0.007846 0.018085 -0.008727 0.000812 0.007915 1.781964 1.377727 -0.184235 -0.217269 1.709294 0.316926 2.258870 -0.000001 57 H 23.466475 23.216790 19.467040 0.084028 1.172288 0.94962306E+01 0.96089577E+02 1.752492 1.730844 -0.661645 2.529003 0.999449 3.584085 9.775391 0.511664 1.183030 -0.732170 -0.009569 -0.022361 -0.012434 0.027316 0.004475 0.007161 0.000402 -0.007064 -0.006630 -0.010087 0.001681 0.008406 1.739135 1.597080 0.337741 0.066561 2.108572 -0.004673 1.511754 0.000003 58 H 26.156032 23.894631 20.162188 0.138190 1.132807 0.87754282E+01 0.85905497E+02 1.633848 1.603212 -0.907898 2.436447 0.999395 3.200358 8.218967 0.569651 1.098360 -0.755921 0.000952 0.015520 0.000123 0.015549 -0.000981 0.001134 0.001655 -0.006312 -0.015019 -0.005587 -0.000422 0.006008 1.608899 1.647551 0.351153 0.123328 1.731725 0.089807 1.447421 -0.000008 59 H 25.350213 22.654324 20.767919 0.134731 1.109349 0.79612608E+01 0.77438044E+02 1.719137 1.602580 -0.935343 2.422952 0.999095 3.426183 9.300149 0.520529 1.209731 -0.724768 -0.011452 -0.005475 0.010022 0.016173 0.000566 -0.003409 -0.005284 0.006132 -0.002303 -0.007400 0.000761 0.006638 1.793970 1.295672 0.046046 -0.092813 1.828675 -0.572012 2.257564 -0.000004 60 H 25.756610 22.662979 19.224747 0.136463 1.161445 0.88766547E+01 0.88448545E+02 1.750402 1.679063 -1.049872 2.369705 0.998330 3.458648 9.406257 0.516118 1.191011 -0.729861 -0.004408 -0.004557 -0.014792 0.016094 -0.003873 0.003125 0.002115 0.004507 0.004244 -0.006660 0.001734 0.004926 1.776105 1.417360 -0.179485 -0.243877 1.815858 0.421114 2.095097 0.000039 61 H 6.966346 5.535214 12.319414 0.129122 1.175709 0.87492702E+01 0.86026331E+02 1.710587 1.631891 -0.940872 2.434479 0.998493 3.217517 8.421330 0.545764 1.141411 -0.744854 -0.025005 -0.012142 -0.020944 0.034805 0.000744 0.016802 -0.002395 -0.007456 -0.018586 -0.020637 0.006878 0.013760 1.714584 1.850182 0.203261 0.324012 1.609026 0.167413 1.684543 0.000227 62 H 7.348324 7.799495 12.385756 0.095740 1.298574 0.95125102E+01 0.95633163E+02 1.836319 1.705623 -0.882328 2.444522 0.998676 3.387636 9.004407 0.531240 1.146838 -0.742990 -0.020406 0.021487 -0.022404 0.037149 0.001716 0.017550 -0.003181 -0.010665 -0.016423 -0.022051 0.008327 0.013724 1.895439 1.776824 -0.430122 0.241251 2.144610 -0.343243 1.764884 -0.000188 63 H 9.014036 8.705206 13.741440 0.110228 1.037922 0.70285188E+01 0.67362435E+02 1.741757 1.581881 -0.993156 2.398055 0.997470 3.629339 10.316332 0.478671 1.335103 -0.695635 0.004768 0.036968 0.005880 0.037735 -0.002887 0.013949 0.001650 -0.015279 -0.022660 -0.020092 0.008047 0.012046 1.885093 1.428844 0.104788 -0.028888 2.798565 -0.030340 1.427870 0.000130 64 H 10.386724 7.271640 14.932711 0.108226 1.228102 0.93343919E+01 0.95512862E+02 1.899757 1.789187 -1.318923 2.243724 0.993790 3.833466 11.058954 0.465451 1.286046 -0.706041 0.028715 0.018414 0.019595 0.039340 0.007573 0.006793 0.001508 -0.000645 -0.020739 -0.010715 -0.002099 0.012814 1.939865 1.939144 0.208127 0.427070 1.974664 0.219685 1.905786 0.000042 65 H 12.216396 1.023951 17.615234 0.127030 0.971591 0.74221054E+01 0.72812488E+02 1.728228 1.673062 -1.277005 2.269688 0.992742 3.884614 11.530722 0.441468 1.414257 -0.679077 0.021290 0.010866 0.015195 0.028323 0.002780 0.002914 -0.001895 0.013076 0.012300 -0.009602 0.002349 0.007252 1.772123 2.140042 0.285896 0.228959 1.591217 0.127718 1.585110 -0.000244 66 H 20.368770 28.590496 16.827783 0.125266 0.974336 0.71245226E+01 0.68267680E+02 1.656349 1.580034 -0.849334 2.466796 0.998074 3.525734 9.903292 0.486450 1.314039 -0.700932 0.003000 -0.022650 -0.007900 0.024175 -0.002239 -0.002966 0.000328 -0.008058 0.008277 -0.006811 0.002373 0.004438 1.728673 1.480942 -0.230740 -0.094770 2.045038 0.461555 1.660039 0.000382 67 H 18.328057 28.763560 18.114240 0.087926 1.082057 0.86012469E+01 0.86707998E+02 1.786772 1.744866 -1.154316 2.308995 0.993445 3.963820 11.557047 0.457735 1.327376 -0.696614 -0.024385 -0.000771 -0.011363 0.026913 0.004511 0.000790 0.004427 0.012516 -0.004683 -0.009098 0.000135 0.008963 1.812509 2.088954 0.269098 0.323594 1.617069 0.246807 1.731505 0.000041 68 H 19.597836 28.405889 19.014184 0.093082 1.103084 0.85683823E+01 0.85365165E+02 1.748132 1.695163 -0.785879 2.481483 0.998118 3.638828 10.180833 0.488842 1.257637 -0.713760 0.018134 -0.013009 0.018882 0.029234 -0.009857 -0.000816 -0.004321 -0.000746 0.002583 -0.011373 0.001193 0.010180 1.771411 1.650632 -0.328407 0.288074 1.779319 -0.305579 1.884284 0.000061 69 H 9.757075 2.160417 18.780545 0.091140 1.015093 0.82637561E+01 0.82214880E+02 1.694702 1.699486 -0.899588 2.428904 0.996274 3.791582 10.868938 0.469726 1.310657 -0.701048 -0.015388 0.015303 -0.016460 0.027238 -0.008193 0.003264 -0.002291 -0.005444 0.011396 -0.010658 0.001320 0.009338 1.690702 1.605359 -0.233514 0.156616 1.688150 -0.241628 1.778596 -0.000102 70 H 11.042552 1.820052 19.663181 0.097093 0.988684 0.78434751E+01 0.77189779E+02 1.680094 1.667245 -0.931802 2.420510 0.995510 3.766385 10.814819 0.468309 1.328990 -0.697098 0.023436 0.003947 0.011738 0.026507 0.000430 -0.000945 0.004780 0.011125 0.007746 -0.008896 0.003731 0.005166 1.690458 2.029370 0.247335 0.206054 1.464897 0.142861 1.577108 -0.000009 71 H 8.412299 0.847997 20.208339 0.070919 1.349131 0.11151940E+02 0.11743604E+03 1.918821 1.870510 -0.848928 2.431097 0.997939 3.805269 10.577905 0.494372 1.176524 -0.733389 -0.021929 0.001062 -0.011094 0.024599 0.001672 -0.001361 0.006706 0.010564 0.000861 -0.010160 0.004663 0.005497 1.927190 2.461804 0.203248 0.318229 1.543602 0.156964 1.776165 0.000003 72 H 9.696032 0.473020 21.085207 0.081054 1.258689 0.10235846E+02 0.10540365E+03 1.826676 1.788429 -0.837846 2.445230 0.998213 3.665037 10.043520 0.507602 1.171793 -0.734826 0.020201 -0.010567 0.016986 0.028429 -0.004760 -0.000528 0.000930 -0.002039 0.015287 -0.007418 0.001965 0.005454 1.824766 1.707853 -0.342026 0.238644 1.818953 -0.344832 1.947492 0.000052 73 H 9.875684 2.662305 21.838044 0.138274 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0.72013922E+02 1.704683 1.601792 -0.966074 2.415763 0.998072 3.522510 9.850958 0.490821 1.291234 -0.705876 0.015002 0.029780 0.024317 0.041270 0.005771 0.011348 0.007568 0.000882 -0.005088 -0.012056 -0.004588 0.016644 1.764093 1.674331 0.149213 0.168182 1.948935 0.504714 1.669012 0.000030 107 H 22.181012 16.588349 26.724274 0.129034 0.936932 0.67728170E+01 0.63867848E+02 1.594995 1.525883 -0.713009 2.532232 0.999345 3.401324 9.374951 0.503835 1.289153 -0.706645 -0.023888 -0.003648 0.000553 0.024171 0.000514 -0.000606 -0.003235 0.004172 -0.008055 -0.005096 0.001372 0.003723 1.639074 2.043417 0.299275 -0.255112 1.437294 -0.056194 1.436511 0.000549 108 H 23.384510 17.517137 27.226165 0.129923 1.045327 0.80173141E+01 0.79702545E+02 1.780959 1.713050 -1.199178 2.310639 0.993618 3.758905 11.013460 0.448870 1.372595 -0.688298 0.007673 0.023625 0.015677 0.029374 -0.002186 0.000822 0.003181 -0.015717 0.000015 -0.008358 -0.000815 0.009173 1.846815 1.548933 0.169921 0.189028 1.812506 0.426444 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0.070735 1.351244 0.11173173E+02 0.11770943E+03 1.920194 1.871781 -0.848075 2.430889 0.997882 3.808342 10.586871 0.494432 1.175885 -0.733528 -0.021630 -0.000902 0.011322 0.024431 -0.001402 0.001455 0.006821 0.010906 -0.000473 -0.010316 0.004419 0.005897 1.928574 2.463769 -0.203541 -0.318591 1.544607 0.157176 1.777347 -0.000002 129 H 18.417025 13.949097 22.181291 0.080081 1.260899 0.10252686E+02 0.10557051E+03 1.824598 1.786404 -0.823642 2.449977 0.998294 3.668465 10.037084 0.509622 1.167221 -0.735893 0.020806 0.010632 -0.016923 0.028850 0.004606 0.000549 0.000680 -0.002129 0.015297 -0.007277 0.001936 0.005340 1.822696 1.706111 0.341594 -0.238353 1.816964 -0.344269 1.945012 0.000055 130 H 18.596678 11.759812 21.428454 0.138581 0.965143 0.71623137E+01 0.68595045E+02 1.633588 1.576409 -0.882541 2.456114 0.999038 3.457179 9.650441 0.491531 1.301116 -0.703952 0.021012 0.006208 -0.000033 0.021910 0.004817 -0.003909 0.002200 0.008390 -0.005784 -0.007832 -0.000290 0.008122 1.656607 1.958305 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21.809487 20.162174 19.371853 0.137066 1.134215 0.87888251E+01 0.86062868E+02 1.634645 1.603990 -0.907305 2.436701 0.999404 3.203260 8.225615 0.569793 1.097750 -0.756084 -0.001614 -0.000082 -0.016089 0.016170 -0.001337 -0.001273 -0.001759 0.003957 0.016673 -0.005550 -0.000462 0.006012 1.609668 1.648370 -0.123474 0.351249 1.448242 -0.089940 1.732390 -0.000008 401 H 22.615309 20.767903 20.612160 0.135329 1.105840 0.79304677E+01 0.77060005E+02 1.715239 1.599293 -0.936080 2.422918 0.999075 3.419903 9.276874 0.521180 1.209451 -0.724846 0.011461 0.009811 0.005406 0.016026 0.003481 0.000483 0.005206 0.004497 -0.008120 -0.007427 0.000777 0.006651 1.789686 1.293293 0.092524 0.045901 2.251523 0.569747 1.824241 -0.000003 402 H 22.208911 19.224731 20.603506 0.136093 1.161424 0.88757709E+01 0.88427719E+02 1.749448 1.678242 -1.047725 2.370402 0.998325 3.458913 9.402928 0.516642 1.189965 -0.730103 0.004192 -0.015098 0.004542 0.016314 -0.003335 -0.003964 -0.002266 0.000488 -0.008377 -0.006838 0.001741 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12.045448 18.780539 12.261726 0.092097 1.010823 0.82207432E+01 0.81695611E+02 1.691525 1.696441 -0.905491 2.427651 0.996229 3.783535 10.846444 0.469484 1.312797 -0.700630 0.015258 -0.016205 -0.014873 0.026770 -0.003145 -0.008435 0.002121 -0.008822 0.002096 -0.011013 0.001713 0.009300 1.687487 1.602459 -0.156094 -0.232721 1.775074 0.240792 1.684928 -0.000103 412 H 10.759973 19.663175 12.602089 0.095902 0.991291 0.78660268E+01 0.77433669E+02 1.679893 1.667061 -0.917549 2.425396 0.995664 3.767331 10.803734 0.469627 1.324886 -0.697940 -0.024100 0.012342 -0.003826 0.027345 0.001274 0.000628 -0.004743 0.001559 -0.019749 -0.008698 0.003409 0.005289 1.690253 2.029057 -0.205942 0.247332 1.576907 -0.142843 1.464795 -0.000009 413 H 13.390227 20.208332 13.574143 0.071327 1.349201 0.11155323E+02 0.11750998E+03 1.921179 1.872695 -0.857614 2.428031 0.997901 3.805031 10.587617 0.493208 1.178917 -0.732834 0.021510 -0.010870 -0.000767 0.024113 0.001151 0.001363 -0.006721 0.005307 -0.016549 -0.010192 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0.002954 0.014530 1.831378 2.088252 0.206836 0.517210 1.611304 0.141385 1.794577 0.000212 425 H 18.607120 20.502556 5.307357 0.093087 1.246320 0.90400544E+01 0.90280216E+02 1.818527 1.685433 -0.894956 2.435392 0.998461 3.481552 9.408192 0.520477 1.178374 -0.733498 0.015818 -0.026572 0.019305 0.036454 0.002167 0.016621 -0.004258 -0.005055 -0.024872 -0.021468 0.007365 0.014103 1.888784 1.683717 -0.381341 0.200541 2.336524 -0.380663 1.646112 -0.000156 426 H 16.733847 20.069892 3.951673 0.111453 1.068603 0.74166677E+01 0.72100441E+02 1.781458 1.630610 -1.016716 2.388548 0.997184 3.672978 10.541699 0.468656 1.344382 -0.693890 -0.017005 -0.036210 -0.003982 0.040202 0.003701 0.014486 -0.001731 -0.020330 -0.019261 -0.021601 0.007512 0.014090 1.909416 1.692135 0.428284 0.022289 2.607436 0.040377 1.428678 0.000239 427 H 15.727442 21.832283 2.846936 0.104559 1.056841 0.76900145E+01 0.76029231E+02 1.808609 1.689936 -1.424639 2.193449 0.992242 3.997840 11.870492 0.444845 1.392658 -0.682442 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1.797436 -1.079952 2.345939 0.994563 3.879179 11.229279 0.460245 1.299816 -0.703489 -0.021809 -0.017398 -0.002229 0.027987 0.001735 -0.002888 -0.001600 -0.010379 -0.020306 -0.008128 -0.001001 0.009129 1.810824 1.924116 0.353634 -0.072119 2.020125 -0.186692 1.488232 -0.000093 431 H 5.947726 0.778792 4.072820 0.098001 1.282800 0.10639850E+02 0.11022810E+03 1.841010 1.820615 -0.713215 2.514717 0.999363 3.503327 9.515819 0.506078 1.168240 -0.738061 0.018983 0.013679 0.021601 0.031844 -0.000456 0.007850 0.008406 0.002701 0.005646 -0.011517 -0.000365 0.011882 1.833255 1.804953 -0.019866 0.410583 1.567739 0.001017 2.127074 0.000062 432 H 5.359928 2.619063 2.947891 0.088573 1.232854 0.99307941E+01 0.10105994E+03 1.785648 1.749748 -0.685674 2.521847 0.999677 3.478882 9.346084 0.520610 1.156108 -0.740457 -0.003211 0.016830 0.019161 0.025704 -0.003379 0.001281 0.006679 0.002133 -0.001335 -0.008471 0.001967 0.006503 1.784461 1.881923 0.392231 0.068739 2.012397 0.037096 1.459064 0.000010 433 H 4.745969 1.791232 1.727775 0.097868 0.976668 0.74522084E+01 0.72701854E+02 1.696836 1.646015 -1.114438 2.342146 0.994094 3.802791 11.017099 0.460502 1.363371 -0.689851 -0.017276 -0.008655 -0.020149 0.027917 -0.002168 0.002955 0.001913 0.005447 -0.001325 -0.005122 0.000331 0.004792 1.725975 1.455572 -0.086730 -0.078485 1.436294 -0.108726 2.286058 0.000088 434 H 3.722126 2.117170 4.136277 0.081456 1.326026 0.10648253E+02 0.10920122E+03 1.803144 1.754078 -0.808884 2.458851 0.999009 3.475727 9.080917 0.551196 1.083554 -0.759899 0.022101 0.005264 0.014893 0.027166 -0.002970 0.006553 0.002021 0.004703 -0.009907 -0.008525 0.000382 0.008142 1.794320 1.501731 -0.059689 -0.131591 1.457417 0.083304 2.423813 0.000014 435 H 3.111655 1.246072 2.942122 0.083673 1.188509 0.95700174E+01 0.98241381E+02 1.842589 1.793665 -1.135568 2.314209 0.995360 3.904161 11.171312 0.473285 1.260670 -0.711696 0.001621 -0.022611 -0.019372 0.029819 -0.001662 -0.000185 0.005138 -0.004905 -0.011660 -0.006398 -0.000781 0.007179 1.839241 2.026133 0.488433 0.089968 2.049841 0.061795 1.441749 0.000043 436 H 3.554680 4.153583 2.595990 0.142045 1.159015 0.90032999E+01 0.88984514E+02 1.678505 1.639280 -0.937341 2.424095 0.999285 3.252519 8.480386 0.553678 1.119272 -0.749984 0.013186 0.005518 0.005073 0.015167 0.002385 0.003703 -0.000465 -0.001114 -0.003198 -0.004924 0.000851 0.004073 1.668014 1.692280 0.344176 -0.003753 1.933282 -0.005358 1.378480 -0.000004 437 H 2.129670 3.588233 3.051730 0.141520 1.140571 0.83455077E+01 0.80384808E+02 1.614888 1.539745 -0.948742 2.414026 0.999503 3.146887 7.921933 0.596910 1.065311 -0.764489 -0.010997 -0.004315 0.013353 0.017828 0.002250 -0.005377 -0.001248 0.003530 0.005748 -0.004570 -0.002788 0.007358 1.633330 1.975377 -0.192603 -0.420035 1.364477 0.076670 1.560135 0.000009 438 H 2.700022 3.239218 1.595092 0.138786 1.009113 0.75027441E+01 0.72376232E+02 1.650329 1.587737 -0.930563 2.432059 0.998411 3.457078 9.547269 0.503921 1.259993 -0.712747 -0.002357 -0.010950 -0.014089 0.017999 -0.000565 0.005718 0.004292 -0.004117 0.018658 -0.008279 -0.001630 0.009909 1.653308 1.419535 -0.011700 0.228877 1.337139 0.023692 2.203250 0.000001 439 H 17.735019 26.196427 7.326460 0.094935 1.161082 0.80270530E+01 0.79597496E+02 1.885911 1.696782 -1.184074 2.313297 0.994606 3.766465 10.920000 0.459236 1.345015 -0.693765 0.045756 -0.002670 0.009492 0.046806 -0.003506 0.001809 -0.002589 0.022620 0.008839 -0.013634 0.002660 0.010974 2.005817 2.962730 -0.015666 0.192281 1.378435 -0.011615 1.676286 0.000520 440 H 16.261172 26.107007 9.100387 0.125475 1.125604 0.79692574E+01 0.78656864E+02 1.815365 1.668362 -1.286996 2.268146 0.994020 3.723283 10.669702 0.473798 1.309766 -0.700383 0.010856 -0.006363 0.031796 0.034195 -0.005309 -0.003751 -0.004235 0.019057 0.015888 -0.014837 0.004787 0.010050 1.904710 1.736633 0.000513 0.356823 1.310509 -0.025972 2.666989 0.000747 441 H 13.241958 26.398339 6.472668 0.117237 1.108020 0.81262914E+01 0.79473433E+02 1.708164 1.619151 -1.044724 2.374735 0.997609 3.469458 9.452404 0.517682 1.209801 -0.724542 -0.030686 0.000760 -0.008736 0.031914 0.000013 0.003489 0.000106 0.027169 0.026427 -0.017990 0.005501 0.012488 1.742303 2.304207 -0.006166 0.050425 1.249821 -0.040815 1.672880 0.000407 442 H 14.766387 26.418532 4.767968 0.092023 1.107854 0.77962548E+01 0.77057988E+02 1.852389 1.690231 -1.231120 2.289669 0.993595 3.856206 11.310419 0.450959 1.374161 -0.687272 -0.018571 0.001333 -0.043133 0.046980 0.000324 0.005313 -0.000466 0.021077 0.023068 -0.014402 0.001874 0.012529 1.968134 1.621293 -0.033045 0.238871 1.411386 -0.153858 2.871723 0.000488 443 H 13.904759 25.607999 9.818611 0.114153 1.163251 0.94728150E+01 0.96981528E+02 1.829227 1.795506 -1.035780 2.372161 0.996416 3.720933 10.627608 0.468781 1.276222 -0.709621 -0.001027 -0.026970 0.012010 0.029541 0.000359 0.000088 -0.005842 -0.009512 -0.034893 -0.013076 0.001052 0.012024 1.836865 1.807450 -0.129718 0.145301 1.705815 -0.362639 1.997329 0.000126 444 H 13.751268 27.188670 9.662851 0.122308 1.234956 0.10352221E+02 0.10750067E+03 1.869974 1.855263 -0.773876 2.506013 0.998727 3.497486 9.801346 0.473064 1.246834 -0.719494 -0.004787 0.027767 0.009889 0.029862 0.000938 0.003033 0.004429 -0.007840 -0.027447 -0.010855 0.001017 0.009838 1.874104 1.808723 0.106017 -0.014332 1.949514 0.397453 1.864075 0.000070 445 H 11.325080 25.991636 4.214157 0.125769 1.100788 0.81259168E+01 0.79655922E+02 1.733350 1.646392 -0.859360 2.471466 0.999207 3.366968 9.254717 0.499499 1.250909 -0.716827 0.009721 -0.017800 0.026556 0.033415 -0.009876 -0.004339 -0.009844 0.009902 0.021194 -0.018957 0.007095 0.011862 1.770924 1.599155 -0.094050 0.168599 1.636413 -0.353859 2.077205 0.000137 446 H 26.801366 27.182908 4.268961 0.094275 1.162281 0.82294801E+01 0.80830217E+02 1.775945 1.636100 -0.943500 2.413268 0.997905 3.537721 9.695698 0.511242 1.219771 -0.722222 -0.022066 0.003590 0.030790 0.038050 -0.015172 -0.007433 -0.004034 0.009769 0.012545 -0.020437 0.005174 0.015263 1.880506 1.963405 0.034732 -0.628319 1.374361 -0.078880 2.303754 -0.000165 447 H 26.047869 28.382835 2.394080 0.118465 1.165808 0.82546973E+01 0.81323893E+02 1.808421 1.664200 -0.812442 2.493372 0.999153 3.410669 9.431166 0.494138 1.258175 -0.715025 -0.037096 0.018893 -0.000173 0.041631 -0.014829 -0.006118 -0.009870 0.015498 0.016360 -0.024031 0.010023 0.014008 1.909688 2.652831 -0.412013 -0.061562 1.602140 -0.072093 1.474093 0.000130 448 H 9.997738 28.521291 0.542273 0.110158 1.041730 0.74675558E+01 0.72202121E+02 1.706057 1.602959 -0.966813 2.414727 0.998098 3.525775 9.859205 0.490949 1.290321 -0.706069 -0.014681 0.024342 -0.030224 0.041492 -0.011481 0.006288 -0.007587 0.002631 0.001078 -0.011999 -0.005081 0.017080 1.765581 1.675650 -0.168425 0.149453 1.670396 -0.505470 1.950696 0.000031 449 H 25.784523 26.724253 26.678123 0.128733 0.936255 0.67665761E+01 0.63793066E+02 1.594210 1.525184 -0.713648 2.532287 0.999300 3.399785 9.368951 0.503959 1.289160 -0.706658 0.024182 0.000903 0.003693 0.024479 0.000266 0.000344 0.003264 0.005888 -0.001936 -0.005044 0.001659 0.003384 1.638246 2.042265 0.254913 0.299000 1.435850 0.056142 1.436623 0.000556 450 H 24.581024 27.226146 25.749335 0.129483 1.044725 0.80099308E+01 0.79595290E+02 1.778927 1.711220 -1.191513 2.313568 0.993710 3.755545 10.994274 0.449607 1.370926 -0.688642 -0.007544 0.015879 -0.023703 0.029511 -0.001013 -0.001958 -0.003242 -0.008011 0.023520 -0.008412 -0.000737 0.009149 1.844597 1.547358 -0.188647 0.169614 2.176075 -0.425554 1.810359 -0.000060 451 H 25.249055 24.462857 26.107005 0.092324 1.120112 0.86689268E+01 0.86818161E+02 1.773431 1.708197 -0.968398 2.395532 0.996706 3.770142 10.655335 0.484528 1.262240 -0.711474 -0.000816 -0.020085 0.021259 0.029258 0.001283 0.008291 -0.002911 -0.005900 -0.002662 -0.010634 0.003486 0.007147 1.820765 1.465630 -0.217338 0.245807 2.099047 -0.419026 1.897618 0.000017 452 H 25.707777 25.316652 24.837854 0.097335 1.141931 0.90155963E+01 0.88917467E+02 1.643991 1.626664 -0.651834 2.539315 0.999787 3.304179 8.537089 0.564262 1.100608 -0.754998 0.012086 0.008334 -0.022664 0.027003 0.006001 -0.002753 -0.000110 -0.001611 0.008570 -0.007866 0.001942 0.005924 1.624595 1.678843 0.110039 -0.281451 1.434632 0.001525 1.760310 0.000050 453 H 22.993803 24.676306 25.478198 0.094163 1.241194 0.10605277E+02 0.11039758E+03 1.837982 1.847724 -0.721407 2.510237 0.999101 3.588645 9.951472 0.487400 1.207211 -0.727940 -0.013496 -0.010649 0.018848 0.025511 0.005040 -0.003476 0.000229 0.001282 0.011081 -0.007501 0.001304 0.006197 1.808092 1.732952 0.072401 -0.302699 1.629412 0.041990 2.061911 0.000087 454 H 23.401944 25.616634 24.255199 0.096762 1.071016 0.84145348E+01 0.83559469E+02 1.721737 1.686578 -0.797420 2.479730 0.997828 3.631496 10.185883 0.486549 1.267693 -0.711437 -0.001691 0.019011 -0.018657 0.026690 0.002460 0.001808 -0.002063 -0.008499 0.004159 -0.006301 0.001332 0.004969 1.742966 1.403564 -0.220837 0.217392 2.102945 -0.310361 1.722388 -0.000042 455 H 24.103114 22.856229 24.448456 0.086009 1.155517 0.89961550E+01 0.90054748E+02 1.756321 1.700199 -0.629505 2.548013 0.999565 3.557068 9.736981 0.507788 1.204963 -0.726807 -0.002262 -0.021081 0.019833 0.029032 0.001422 0.003478 -0.003487 -0.012948 0.002881 -0.008732 0.000947 0.007785 1.785298 1.379813 -0.218000 0.184797 2.263718 -0.318004 1.712364 -0.000002 456 H 24.499046 23.799441 23.216803 0.082869 1.173354 0.95037080E+01 0.96158856E+02 1.751591 1.729888 -0.650665 2.532712 0.999513 3.585099 9.769431 0.512667 1.180794 -0.732709 0.009996 0.012407 -0.022930 0.027922 0.007279 -0.004182 -0.000222 -0.000001 0.013758 -0.010129 0.002008 0.008121 1.738283 1.596294 0.066590 -0.337677 1.510935 0.004463 2.107621 0.000003 457 H 21.809491 23.104291 23.894645 0.137601 1.133870 0.87865619E+01 0.86046057E+02 1.635436 1.604736 -0.909545 2.435886 0.999376 3.201247 8.224101 0.569081 1.099056 -0.755764 -0.001257 -0.000184 0.016009 0.016059 0.001174 0.001210 -0.001437 0.004129 0.016755 -0.005432 -0.000513 0.005946 1.610450 1.649121 0.123657 -0.351506 1.448909 -0.090154 1.733321 -0.000009 458 H 22.615310 22.498562 22.654338 0.134039 1.106944 0.79375637E+01 0.77111172E+02 1.712911 1.597258 -0.918950 2.429334 0.999036 3.421113 9.265330 0.523096 1.205298 -0.725799 0.011598 -0.010642 -0.005729 0.016751 -0.003414 -0.000414 0.005281 0.004574 -0.007783 -0.007488 0.000924 0.006564 1.787155 1.291802 -0.092448 -0.045907 2.248023 0.568554 1.821641 -0.000003 459 H 22.208910 24.041734 22.662992 0.135920 1.163464 0.88962074E+01 0.88693215E+02 1.752453 1.680930 -1.054166 2.367707 0.998303 3.462323 9.419270 0.515816 1.191037 -0.729848 0.004271 0.015068 -0.004666 0.016342 0.003089 0.003993 -0.002204 0.000646 -0.009036 -0.006788 0.001752 0.005036 1.778230 1.418870 -0.244225 0.179839 2.097402 -0.421959 1.818417 0.000039 460 H 14.836170 2.102746 5.535227 0.129064 1.183179 0.88223668E+01 0.86962352E+02 1.721669 1.641811 -1.000918 2.408021 0.998179 3.224185 8.461001 0.542335 1.145757 -0.743833 0.025279 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-1.341740 2.235387 0.993603 3.834857 11.083636 0.463455 1.290978 -0.705013 -0.028204 -0.019507 0.018069 0.038762 0.006756 -0.007499 -0.001321 0.009707 0.011427 -0.010667 -0.001928 0.012595 1.943957 1.943325 0.428627 -0.208956 1.909650 -0.220487 1.978896 0.000040 464 H 18.307109 25.651277 1.023974 0.127185 0.973728 0.74442914E+01 0.73098859E+02 1.731894 1.676412 -1.287634 2.264895 0.992706 3.892654 11.567364 0.440605 1.415694 -0.678773 -0.021138 -0.015134 0.010605 0.028077 0.002943 -0.002986 0.001777 0.000334 -0.025771 -0.009659 0.002352 0.007307 1.775998 2.145285 0.229851 -0.286931 1.588291 -0.128139 1.594418 -0.000244 465 H 27.596750 26.438692 28.590502 0.124726 0.976009 0.71391297E+01 0.68434291E+02 1.657338 1.580922 -0.841032 2.469969 0.998150 3.528148 9.908033 0.486711 1.312824 -0.701180 -0.003125 0.007809 -0.022950 0.024443 -0.002955 0.002041 -0.000447 -0.008330 0.007224 -0.006675 0.002165 0.004510 1.729744 1.481636 -0.094784 0.230817 1.661085 -0.462111 2.046513 0.000382 466 H 29.637464 25.152234 28.763568 0.087123 1.080667 0.85873876E+01 0.86540273E+02 1.786170 1.744250 -1.156910 2.308201 0.993481 3.962157 11.553330 0.457468 1.328580 -0.696401 0.024939 0.011563 -0.000737 0.027499 0.000588 -0.004498 -0.004375 0.008357 -0.016560 -0.009097 0.000310 0.008787 1.811908 2.088569 0.323679 -0.268919 1.730860 -0.246606 1.616296 0.000041 467 H 28.367687 24.252290 28.405898 0.092403 1.106097 0.85999848E+01 0.85778796E+02 1.753071 1.699670 -0.794529 2.477392 0.997994 3.646274 10.215279 0.487485 1.259688 -0.713304 -0.018128 -0.019134 -0.013081 0.029425 -0.000683 0.009931 0.004273 -0.001415 -0.000188 -0.011328 0.001014 0.010314 1.776530 1.655131 0.289431 0.329969 1.889935 0.307153 1.784524 0.000060 468 H 20.766433 24.485964 2.160440 0.091003 1.015011 0.82639349E+01 0.82225903E+02 1.695392 1.700169 -0.906055 2.426466 0.996205 3.792725 10.876627 0.469306 1.311681 -0.700836 0.015256 0.016365 0.015300 0.027104 0.003185 0.008458 0.002467 -0.008261 0.001347 -0.010825 0.001279 0.009546 1.691372 1.605913 0.156626 0.233685 1.779244 0.241832 1.688960 -0.000103 469 H 19.480958 23.603328 1.820077 0.096219 0.989826 0.78492309E+01 0.77213562E+02 1.677130 1.664398 -0.912108 2.428124 0.995738 3.761128 10.775973 0.470458 1.323483 -0.698247 -0.024056 -0.011980 0.003992 0.027168 -0.001282 -0.000542 -0.004842 0.001503 -0.020307 -0.008894 0.003452 0.005441 1.687426 2.025443 0.205518 -0.246627 1.574331 -0.142474 1.462503 -0.000010 470 H 22.111211 23.058171 0.848023 0.070668 1.353206 0.11193065E+02 0.11797228E+03 1.922103 1.873466 -0.848238 2.430807 0.997884 3.810772 10.596265 0.494199 1.175909 -0.733519 0.021794 0.011212 0.001015 0.024530 -0.001318 -0.001616 -0.006737 0.005376 -0.016548 -0.010289 0.004537 0.005752 1.930561 2.466899 0.319332 -0.203881 1.779039 -0.157415 1.545744 0.000002 471 H 20.827480 22.181303 0.473047 0.079739 1.262954 0.10275454E+02 0.10588103E+03 1.828089 1.789629 -0.830783 2.447183 0.998236 3.671344 10.053966 0.508549 1.168844 -0.735516 -0.020398 -0.017269 -0.010461 0.028700 -0.000511 0.004952 -0.000690 -0.008554 -0.004019 -0.007554 0.002326 0.005228 1.826231 1.709263 0.239224 0.342681 1.949073 0.345472 1.820357 0.000051 472 H 20.647830 21.428463 2.662332 0.138622 0.964161 0.71536156E+01 0.68488897E+02 1.632286 1.575325 -0.923472 2.437139 0.998734 3.455249 9.642510 0.491774 1.300907 -0.704001 -0.021174 0.000044 -0.006471 0.022141 0.003735 0.004719 -0.002283 0.006894 -0.009579 -0.007734 -0.000144 0.007878 1.655215 1.956195 0.347643 -0.223293 1.675584 -0.153707 1.333865 0.000048 473 H 22.146097 21.165980 2.163325 0.130055 1.050540 0.75085831E+01 0.71631402E+02 1.629833 1.535300 -0.822919 2.468805 0.999772 3.299411 8.732469 0.545382 1.177225 -0.733208 0.009026 -0.006861 -0.013552 0.017669 -0.006432 -0.002892 0.001024 -0.001462 0.003200 -0.007286 0.000127 0.007159 1.699279 1.784428 -0.538554 -0.104617 2.054620 0.102961 1.258788 -0.000000 474 H 21.826909 22.403401 3.129610 0.135645 1.038370 0.80185674E+01 0.78344278E+02 1.665732 1.630749 -0.817096 2.481538 0.999673 3.395191 9.317495 0.504066 1.243680 -0.717852 0.001553 0.018839 0.004236 0.019371 0.001064 0.000834 0.002748 -0.007891 0.002942 -0.004624 -0.000792 0.005416 1.665838 1.537159 0.181285 0.231618 1.696360 0.331835 1.763994 0.000004 475 H 27.703126 28.299174 12.388641 0.088231 1.151023 0.82653662E+01 0.82557470E+02 1.866393 1.716118 -1.233106 2.279807 0.994798 3.868165 11.253456 0.458932 1.336175 -0.694950 -0.009485 0.042091 0.021029 0.047999 -0.000058 -0.008499 0.007549 -0.029287 -0.014667 -0.018301 -0.001355 0.019657 1.969270 1.653873 -0.313931 -0.203224 2.412319 0.546218 1.841617 0.000677 476 H 28.868249 28.235719 10.381075 0.124343 1.122462 0.86449272E+01 0.85624678E+02 1.714253 1.667702 -1.017167 2.395071 0.997951 3.385719 9.198896 0.512580 1.206442 -0.727067 0.012484 0.027049 -0.015854 0.033747 0.005218 -0.013472 -0.004056 -0.017054 0.008650 -0.018675 0.002815 0.015860 1.691982 1.563415 0.085219 -0.161810 1.930413 -0.158629 1.582119 0.000361 477 H 11.349507 24.232123 10.606061 0.120794 1.078554 0.79731724E+01 0.78155893E+02 1.725683 1.641999 -1.060282 2.372178 0.997300 3.532072 9.858859 0.492753 1.268078 -0.711032 0.011155 -0.027707 -0.010310 0.031597 -0.003845 -0.014470 0.003294 -0.009671 0.000850 -0.017088 0.002262 0.014826 1.763661 1.507712 -0.104475 -0.090521 2.287123 0.236972 1.496147 0.000407 478 H 27.528709 24.399418 12.504018 0.087089 1.172855 0.86199475E+01 0.86755208E+02 1.872886 1.740798 -1.206446 2.296859 0.993666 3.817457 11.042685 0.461628 1.318327 -0.699323 -0.012588 -0.038769 0.019669 0.045259 -0.001028 -0.006963 -0.004011 -0.021565 -0.007123 -0.014171 0.001126 0.013045 1.936443 1.711052 0.358654 -0.286023 2.355137 -0.400626 1.743140 0.000814 479 H 11.959973 26.891575 8.338896 0.114341 1.214755 0.97081658E+01 0.98883287E+02 1.818788 1.769822 -0.763492 2.504802 0.998835 3.466669 9.519515 0.497012 1.209911 -0.727292 0.001454 0.025793 -0.012094 0.028524 -0.001157 0.002035 -0.005705 -0.004687 -0.013692 -0.007541 -0.000290 0.007831 1.824075 1.822934 -0.219167 0.070309 1.687771 -0.310731 1.961519 0.000082 480 H 12.118696 25.302251 8.480234 0.111248 1.206206 0.96852333E+01 0.98327176E+02 1.791096 1.753415 -0.753993 2.506479 0.999085 3.433524 9.330921 0.506818 1.190393 -0.732217 0.006659 -0.026887 -0.006557 0.028465 -0.000463 0.000396 0.002696 -0.008508 -0.017198 -0.006322 -0.001357 0.007679 1.798502 1.663861 0.203120 -0.013832 1.958437 0.294439 1.773210 0.000029 481 C 12.481515 4.343356 19.694333 0.321180 29.727827 0.34653155E+03 0.77504173E+04 8.623536 6.457434 -0.108294 1.984414 0.999388 25.309402 72.562589 0.606898 0.451241 -1.035976 -0.039486 0.019073 -0.063770 0.077392 0.005157 0.024479 -0.011011 0.009345 0.065297 -0.028556 -0.008364 0.036920 10.187226 8.653804 -2.874308 0.926417 6.909551 0.753576 14.998323 0.003966 482 C 11.878023 4.985718 20.780322 -0.223776 36.172756 0.46709831E+03 0.11201019E+05 9.480626 7.211999 0.048866 1.977817 0.999412 30.699203 89.674795 0.611678 0.417575 -1.061494 0.005174 -0.000944 0.016783 0.017588 -0.022393 0.021122 -0.010760 0.016835 -0.029047 -0.022957 -0.016969 0.039926 11.000665 8.958163 -2.880417 0.959967 7.359344 0.977811 16.684489 0.004922 483 C 12.347214 4.850437 22.049184 -0.079731 31.753351 0.41516515E+03 0.96563545E+04 8.652855 6.760263 0.169639 2.018493 0.999691 29.167044 83.618888 0.637935 0.412798 -1.065680 0.016261 -0.010469 -0.029530 0.035300 -0.021396 -0.013501 0.018916 0.006351 0.019964 -0.026361 -0.009623 0.035985 9.839769 8.851075 -2.642628 1.235461 6.543547 0.465000 14.124686 0.003826 484 C 13.454782 4.047698 22.311379 -0.131538 33.874261 0.45460304E+03 0.10843299E+05 9.181905 7.172700 0.092248 2.002637 0.999337 29.820568 87.284457 0.605080 0.424389 -1.055689 -0.002687 0.004309 -0.029676 0.030108 -0.014802 0.020234 -0.000356 0.009030 0.066555 -0.029712 -0.004013 0.033725 10.694506 9.659496 -2.789049 1.283704 7.118614 1.175875 15.305408 0.010084 485 C 14.046065 3.403893 21.262022 -0.085538 36.604369 0.45340570E+03 0.10867352E+05 9.825124 7.272093 -0.261966 1.885935 0.999039 30.302716 90.526621 0.584260 0.437384 -1.041999 -0.027962 0.018125 -0.015734 0.036850 0.003532 0.011991 -0.014425 0.005774 -0.076918 -0.033895 0.014937 0.018958 12.053750 8.960748 -2.655422 0.915821 7.554360 1.837687 19.646143 0.004050 486 C 13.603037 3.526772 19.954797 -0.168737 45.206180 0.52241958E+03 0.12804166E+05 10.944776 7.586872 -0.038927 1.965035 0.999180 29.857545 86.420477 0.604835 0.413178 -1.070870 0.017123 -0.008491 0.036483 0.041187 -0.008156 -0.004967 0.010707 -0.005238 0.072200 -0.020741 -0.007642 0.028383 14.180814 11.375383 -4.337393 -0.510527 9.154904 2.789862 22.012156 0.008179 487 C 14.326879 2.776820 18.896787 0.458090 28.544749 0.29447480E+03 0.63579343E+04 8.650160 6.084910 -0.001061 2.042291 0.999676 23.864618 68.428120 0.601654 0.471511 -1.019106 0.051726 -0.048500 0.000798 0.070911 0.042430 -0.004611 -0.003453 -0.015598 -0.066755 -0.032200 -0.022475 0.054675 10.955823 8.813915 -3.385675 -1.430013 7.612348 2.208267 16.441206 0.030878 488 C 14.489086 2.655967 15.502098 0.477646 25.234060 0.28852466E+03 0.61790656E+04 7.938333 5.979268 -0.025459 2.037761 0.999655 23.305004 65.899259 0.615491 0.464670 -1.025931 -0.033597 0.033724 -0.019439 0.051420 0.045640 -0.008930 0.018568 0.004391 -0.108540 -0.052169 -0.012032 0.064201 9.650429 8.606282 -3.226607 -2.890245 7.020280 2.108784 13.324725 0.019405 489 C 15.277463 2.126098 14.337075 -0.309077 32.229141 0.50756393E+03 0.12423096E+05 8.856411 7.463668 -0.227965 1.906597 0.997067 31.133675 91.789154 0.608026 0.411571 -1.065665 0.045629 0.059652 -0.024008 0.078847 0.019717 -0.015627 -0.027284 0.012694 -0.054906 -0.037075 -0.006720 0.043795 10.257613 10.122347 -1.030990 -3.470916 8.627469 2.495037 12.023024 -0.002644 490 C 16.323982 3.222761 13.836338 -0.153106 26.097552 0.43490088E+03 0.10283746E+05 7.801307 7.008862 -0.129582 1.949601 0.998731 29.506204 86.667343 0.611518 0.423581 -1.053661 -0.021213 -0.089173 -0.034830 0.098056 0.017424 -0.035544 -0.030858 0.044461 -0.029208 -0.046788 -0.014588 0.061376 8.335736 9.025923 -0.302686 -2.850096 6.758895 1.084921 9.222390 0.001515 491 C 17.005963 2.717121 12.581898 -0.163149 23.039177 0.32962390E+03 0.73223360E+04 7.152377 6.062414 -0.055849 1.983647 0.998834 28.380526 82.618142 0.659434 0.418123 -1.049895 0.033513 0.051515 0.054971 0.082455 -0.044725 -0.032469 -0.020862 -0.020801 0.090606 -0.075048 0.029917 0.045131 7.785229 9.495105 0.609902 -2.325069 6.097138 0.798577 7.763444 0.000349 492 C 18.129227 3.149786 12.385756 -0.119741 22.366273 0.33079180E+03 0.73185726E+04 6.907376 6.010928 0.085217 2.022651 0.999719 27.971706 79.963755 0.675888 0.409600 -1.060536 -0.031975 -0.069843 -0.076286 0.108259 -0.056277 -0.040467 -0.002242 -0.017249 0.129579 -0.086806 0.018267 0.068539 7.274497 9.051174 0.757856 -1.579050 5.921546 0.383965 6.850771 0.000084 493 C 18.863534 2.535404 11.027188 -0.462956 26.997811 0.45955078E+03 0.10905393E+05 7.545209 6.896694 0.457036 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15.938514 7.997650 16.965371 0.176863 32.994284 0.36728194E+03 0.82182786E+04 9.051554 6.417261 0.045971 2.042950 0.999230 24.790702 67.895971 0.651019 0.420466 -1.069385 0.024857 0.020252 -0.000956 0.032077 0.024717 0.004640 -0.000133 0.006003 0.011336 -0.027117 0.003524 0.023593 11.651195 14.853068 5.001849 -0.090626 15.819576 0.117104 4.280943 0.001075 497 C 16.353635 6.673983 16.904509 -0.214865 35.204266 0.43955977E+03 0.10339772E+05 9.242219 6.925735 0.285299 2.058223 0.999798 29.754219 84.951151 0.636309 0.409209 -1.071207 -0.010109 -0.004130 -0.000512 0.010932 -0.004061 -0.003285 -0.003804 0.036233 -0.035457 -0.016492 -0.008208 0.024700 11.004388 11.829606 3.398721 0.109223 16.766039 0.553578 4.417519 0.001435 498 C 15.446651 5.663277 16.895279 0.096551 28.192666 0.34016553E+03 0.75579511E+04 8.209276 6.243361 0.141333 2.061271 0.999684 26.254510 74.542915 0.641526 0.429712 -1.050782 -0.039707 0.026319 0.001977 0.047678 -0.030672 0.005537 -0.002545 -0.013071 0.097400 -0.047685 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0.43615526E+03 0.10287014E+05 9.259778 7.003476 0.023804 1.974606 0.999581 29.446071 85.458760 0.615801 0.421713 -1.058293 -0.023927 0.015566 0.017597 0.033532 -0.022167 -0.003989 0.016760 -0.010655 0.019760 -0.027881 -0.002373 0.030253 11.084195 15.179111 4.041241 -1.862756 10.969280 2.371039 7.104196 0.005120 505 C 19.064124 1.198462 15.990432 -0.167365 44.872372 0.51645912E+03 0.12615345E+05 10.892916 7.551886 0.000341 1.979803 0.999264 29.677502 85.610648 0.605531 0.414101 -1.070823 0.035390 -0.000005 -0.026675 0.044317 0.012443 -0.006880 -0.000922 0.010732 -0.026732 -0.012699 -0.006704 0.019403 14.086181 17.141817 5.846237 -1.717160 15.932025 4.343506 9.184702 0.007695 506 C 18.228652 0.015555 15.807271 0.462529 30.023510 0.28958709E+03 0.62134247E+04 8.859511 5.989544 0.006940 2.043642 0.999571 23.615354 67.047185 0.614490 0.464558 -1.025018 0.000534 -0.051862 -0.034816 0.062467 -0.019175 0.038628 -0.040740 -0.007015 0.025411 -0.044593 -0.023467 0.068060 11.547895 13.057442 4.428902 -1.777141 13.281727 3.728212 8.304517 0.032168 507 C 24.031591 27.489218 16.923546 0.484060 25.047485 0.28932468E+03 0.61985881E+04 7.861096 6.000449 -0.062456 2.026920 0.999527 23.208009 65.571909 0.612612 0.466674 -1.025142 -0.022553 0.028206 0.049722 0.061453 -0.017804 0.032764 -0.037440 -0.030811 0.012746 -0.042874 -0.019361 0.062235 9.149065 8.998939 2.731788 -2.744182 10.696851 1.488327 7.751406 0.016472 508 C 23.077514 26.333425 16.779613 -0.290516 30.200258 0.47218402E+03 0.11338252E+05 8.416658 7.165640 -0.089380 1.956970 0.998082 30.275813 88.105717 0.625520 0.407784 -1.069261 0.002582 -0.039135 0.074779 0.084440 -0.001620 -0.000592 -0.007811 -0.030331 0.010745 -0.017097 -0.000637 0.017734 9.273941 7.899916 1.151407 0.304917 10.194641 -1.075818 9.727265 -0.002915 509 C 22.974608 25.511937 18.057994 -0.157566 25.927308 0.41412816E+03 0.96278265E+04 7.629689 6.726913 0.073724 2.010789 0.999670 28.873013 82.802255 0.642961 0.409759 -1.067472 0.079772 0.013685 -0.065653 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515 C 7.892516 7.222319 12.907550 -0.071597 30.657154 0.41030792E+03 0.95133335E+04 8.453307 6.728695 0.129645 2.008468 0.999727 28.965031 82.851719 0.638411 0.413793 -1.065264 0.020048 -0.024483 0.016459 0.035668 -0.016337 0.023934 -0.011635 -0.000377 0.013923 -0.024664 -0.010800 0.035464 9.449456 7.234337 -0.234988 2.053840 14.356862 -0.319302 6.757169 0.004096 516 C 8.886710 7.764015 13.695000 -0.128417 32.762399 0.43806794E+03 0.10332391E+05 8.925089 6.997347 0.219027 2.045698 0.999663 29.333242 84.835855 0.619570 0.419138 -1.061048 -0.007343 -0.030091 0.005382 0.031438 0.007290 0.011428 0.011317 -0.038141 -0.049071 -0.025787 -0.006534 0.032321 10.350252 7.849483 -0.826280 2.485276 15.884743 -1.148104 7.316531 0.009548 517 C 9.685555 6.912817 14.404283 -0.084891 35.263600 0.43793215E+03 0.10381215E+05 9.487684 7.077846 -0.183972 1.909421 0.999438 29.947197 88.288442 0.602335 0.428970 -1.049547 -0.021368 -0.025253 -0.014545 0.036137 0.015730 -0.006784 0.018331 0.025741 -0.000417 -0.032127 0.011477 0.020650 11.552141 8.143589 -2.006063 2.952755 18.615097 -1.982116 7.897737 0.004801 518 C 9.498926 5.525404 14.377169 -0.175090 45.139409 0.52571270E+03 0.12905956E+05 10.940392 7.617521 -0.053372 1.959713 0.999384 29.925282 86.705335 0.602774 0.413914 -1.070326 0.011771 0.044342 0.001062 0.045890 -0.009415 0.008026 -0.013523 -0.031006 -0.053916 -0.023662 -0.008133 0.031796 13.907203 11.121506 -2.641501 4.818501 20.683840 -2.638305 9.916264 0.008504 519 C 10.407656 4.710262 15.194617 0.460493 28.899349 0.28995122E+03 0.62352064E+04 8.682947 6.019745 0.000221 2.041896 0.999718 23.790153 68.046600 0.607740 0.468665 -1.020794 0.054514 0.013774 0.039559 0.068749 -0.010570 -0.038330 0.006247 0.020105 0.089464 -0.033690 -0.022356 0.056046 10.868815 9.957590 -1.552216 4.080400 14.617967 -2.233947 8.030888 0.030394 520 C 10.707662 1.497866 16.301951 0.484383 23.200591 0.27826321E+03 0.59216407E+04 7.513401 5.913117 -0.031478 2.041963 0.999582 23.186654 65.938819 0.610817 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-0.842779 6.370118 1.236682 9.456807 0.000077 526 C 20.058311 12.001247 15.811597 0.094179 26.625088 0.35575638E+03 0.79988709E+04 7.911464 6.409583 0.041622 2.025244 0.999582 26.625735 76.217389 0.629060 0.433050 -1.048035 0.009375 0.006479 0.050178 0.051456 -0.036929 -0.002354 -0.012083 0.028774 -0.001782 -0.042412 0.001881 0.040531 8.898829 7.824096 3.911038 -0.745624 9.780569 -1.464919 9.091821 0.003671 527 C 19.353655 10.805360 15.842749 -0.216330 31.913204 0.46522584E+03 0.11118564E+05 8.712729 7.184498 0.228327 2.042279 0.999366 30.133124 87.195981 0.615972 0.416064 -1.064975 0.002244 0.008443 -0.001761 0.008912 0.007573 0.017644 0.020979 0.017282 -0.020561 -0.028690 -0.003015 0.031704 9.757679 9.121646 4.804318 -1.555465 11.169023 -1.920828 8.982368 0.001651 528 C 19.030980 10.235394 17.062288 0.187678 30.747646 0.38238862E+03 0.86843590E+04 8.777143 6.657366 -0.110943 1.994683 0.999238 25.152633 70.492501 0.620500 0.434641 -1.055502 -0.025971 -0.022369 -0.002016 0.034336 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21.068210 9.571680 21.217314 -0.078990 31.751673 0.41512472E+03 0.96553728E+04 8.652312 6.759587 0.171466 2.018949 0.999706 29.169274 83.630582 0.638003 0.412756 -1.065686 0.016660 0.011212 0.030255 0.036313 0.021244 0.012738 0.018598 0.006017 0.018841 -0.026091 -0.009034 0.035125 9.839073 8.851034 2.643000 -1.234823 6.543354 0.465539 14.122831 0.003821 535 C 22.175777 10.374419 20.955119 -0.133284 33.948643 0.45583677E+03 0.10880741E+05 9.196308 7.183231 0.090421 2.001545 0.999324 29.866719 87.468707 0.604499 0.424484 -1.055568 -0.003173 -0.004602 0.030491 0.030999 0.014289 -0.020201 -0.000160 0.008103 0.069423 -0.029664 -0.004413 0.034077 10.712266 9.674636 2.793656 -1.286003 7.129428 1.178131 15.332736 0.010064 536 C 22.767061 11.018224 22.004476 -0.085921 36.605294 0.45339125E+03 0.10867308E+05 9.825641 7.272155 -0.261190 1.886447 0.999090 30.307944 90.554087 0.584215 0.437406 -1.041949 -0.028892 -0.018906 0.016849 0.038420 -0.004645 -0.012322 -0.013704 0.004653 -0.075317 -0.033388 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8.118702 0.032815 1019 O 12.953114 25.721367 2.333795 -0.498422 40.185330 0.56969038E+03 0.13910697E+05 9.298405 7.400979 0.155179 2.100388 0.998224 27.479625 73.070817 0.695705 0.360554 -1.136463 -0.067713 0.062251 0.009033 0.092422 -0.050780 -0.026627 0.005025 0.054318 -0.125790 -0.052427 -0.031299 0.083726 10.694284 16.430305 -3.724873 -1.702825 8.712607 -0.490924 6.939938 0.053989 1020 O 20.622215 28.261944 27.937178 -0.461034 38.480036 0.49517853E+03 0.11696433E+05 9.252776 6.969820 -0.068597 2.058967 0.995315 26.358897 69.353320 0.704859 0.367885 -1.128675 0.034293 -0.042608 0.021753 0.058861 0.020911 0.018983 -0.030128 -0.065578 0.082880 -0.061319 0.007576 0.053743 11.907908 8.811016 -0.944693 -0.769196 11.876467 -7.536427 15.036240 0.046123 1021 O 24.202362 25.413852 28.385996 -0.493291 34.265059 0.52442794E+03 0.12509545E+05 8.321224 7.056377 0.390142 2.194188 0.997715 26.642850 69.410940 0.721176 0.356048 -1.143107 -0.002549 0.039762 -0.033183 0.051852 -0.002828 0.000091 -0.060469 -0.048060 0.150957 -0.049821 -0.040506 0.090327 9.530802 6.838451 -2.064309 0.284210 9.481961 -3.866146 12.271993 0.037169 1022 O 13.638776 0.901093 3.698997 -0.485682 37.555010 0.51561481E+03 0.12306119E+05 8.961624 7.049714 -0.014547 2.044748 0.997959 27.338599 72.366594 0.710005 0.361451 -1.133370 -0.019665 -0.000892 0.085352 0.087592 -0.000263 -0.006972 0.018887 -0.010461 0.250533 -0.047425 -0.039347 0.086772 10.588496 6.255296 0.170991 -0.279834 6.524993 0.610704 18.985200 0.059609 1023 O 19.144852 27.450294 5.264379 -0.457766 37.561261 0.50540702E+03 0.12004106E+05 9.118304 7.073468 -0.074756 2.066849 0.992979 26.216522 69.261511 0.694645 0.371240 -1.125658 0.040970 0.014642 -0.039863 0.059008 0.024703 -0.005946 -0.022467 0.016263 -0.150164 -0.056923 0.002666 0.054257 10.876991 14.167260 5.501771 -0.540002 8.960516 -0.697861 9.503196 0.047203 1024 O 20.779337 27.674997 0.968016 -0.507996 36.522602 0.60192621E+03 0.14889486E+05 8.761031 7.641492 -0.026896 2.053478 0.995500 27.374237 73.071206 0.680652 0.363785 -1.134845 -0.036174 -0.020468 0.029277 0.050840 0.056491 -0.010088 -0.025562 0.017555 -0.153604 -0.060931 -0.026149 0.087080 9.877865 9.993875 3.874832 -1.387119 10.354059 -1.966262 9.285660 0.033907 ****************************************************** Auxiliary information for the entire system The total spin magnetic moment of the unit cell is 87.840353 The total net atomic charge of the unit cell is 0.000004 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= 587739 The rms potential error without charges in kcal/mol is= 3.21068 The rms potential error with partial charges in kcal/mol is= 1.00866 The RRMSE value at monopole order= 0.31416 The rms potential error with partial charges and cloud penetration in kcal/mol is= 0.99752 The RRMSE value at monopole order with cloud penetration is= 0.31069 The rms potential error with partial charges and atomic dipoles in kcal/mol is= 0.27135 The RRMSE value at dipole order= 0.08451 The rms potential error with partial charges, atomic dipoles and cloud penetration in kcal/mol is= 0.26785 The RRMSE value at dipole order with cloud penetration= 0.08342 ****************************************************** 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.