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0.501704 Ca\n0.530157 0.624817 0.999817 Ca\n0.493353 0.394688 0.507729 Ca\n0.502434 0.855091 0.997489 Ca\n0.497925 0.854448 0.497437 Ca\n0.966703 0.391320 0.997290 Ca\n0.961378 0.389536 0.503364 Ca\n0.966300 0.864661 0.007005 Ca\n0.965449 0.865678 0.509767 Ca\n0.235616 0.399268 0.741768 Ca\n0.232010 0.857375 0.259259 Ca\n0.228581 0.861463 0.753946 Ca\n0.736063 0.395273 0.254095 Ca\n0.731017 0.392455 0.752437 Ca\n0.728696 0.859081 0.246768 Ca\n0.729372 0.859356 0.746619 Ca\n0.226853 0.113061 0.739309 Ca\n0.276478 0.628884 0.269977 Ca\n0.269720 0.628599 0.751293 Ca\n0.771393 0.117773 0.247579 Ca\n0.777770 0.122942 0.755073 Ca\n0.756779 0.623869 0.251409 Ca\n0.768123 0.624314 0.755468 Ca\n0.986108 0.985533 0.261211 Ti\n0.986605 0.989666 0.760029 Ti\n0.999781 0.503741 0.251161 Ti\n0.232537 0.983863 0.011253 Ti\n0.231867 0.989834 0.515961 Ti\n0.248691 0.516961 0.007907 Ti\n0.266197 0.238129 0.934612 Ti\n0.268602 0.234928 0.455256 Ti\n0.251904 0.746786 0.005328 Ti\n0.977214 0.257331 0.267916 Ti\n0.995448 0.257989 0.771097 Ti\n0.999862 0.743012 0.250619 Ti\n0.001425 0.503149 0.748414 Mn\n0.505991 0.988977 0.229985 Mn\n0.506792 0.988575 0.733813 Mn\n0.499072 0.505688 0.253536 Mn\n0.495724 0.506507 0.750300 Mn\n0.247029 0.511888 0.505157 Mn\n0.744169 0.995490 0.991456 Mn\n0.739129 0.995210 0.492140 Mn\n0.750841 0.503445 0.000957 Mn\n0.747049 0.504094 0.504288 Mn\n0.250078 0.750344 0.506948 Mn\n0.751484 0.252137 0.002739 Mn\n0.742307 0.253327 0.505091 Mn\n0.751921 0.747064 0.998582 Mn\n0.749989 0.746435 0.500642 Mn\n0.001260 0.748130 0.749899 Mn\n0.518261 0.257829 0.255849 Mn\n0.514860 0.255998 0.748957 Mn\n0.499861 0.746392 0.254107 Mn\n0.499673 0.745741 0.753083 Mn\n0.110163 0.777891 0.110492 O\n0.108390 0.777630 0.607105 O\n0.566948 0.248851 0.094919 O\n0.579101 0.258598 0.580751 O\n0.611059 0.761743 0.113016 O\n0.612764 0.761817 0.609956 O\n0.396335 0.195553 0.361368 O\n0.397159 0.185291 0.857272 O\n0.396173 0.728891 0.402437 O\n0.391211 0.727419 0.907598 O\n0.899488 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0.862729 O\n0.386070 0.516026 0.400307 O\n0.382922 0.519638 0.899738 O\n0.884842 0.012667 0.389840 O\n0.891742 0.013558 0.895164 O\n0.894249 0.515980 0.385776 O\n0.895929 0.516031 0.888442 O\n0.112271 0.474871 0.103741 O\n0.105794 0.477191 0.602637 O\n0.107978 0.978306 0.117016 O\n0.106131 0.974212 0.615780 O\n0.618788 0.492082 0.119873 O\n0.610894 0.490293 0.613102 O\n0.600291 0.985050 0.079374 O\n0.593753 0.984954 0.578763 O\n0.010033 0.376902 0.283461 O\n0.018747 0.376858 0.788148 O\n0.008543 0.874543 0.296454 O\n0.012442 0.877955 0.798165 O\n0.494877 0.379659 0.280895 O\n0.491726 0.381652 0.768976 O\n0.506813 0.868364 0.284030 O\n0.507025 0.867406 0.786078 O\n0.487774 0.626385 0.215006 O\n0.485359 0.626799 0.714350 O\n0.994261 0.135019 0.224155 O\n0.006049 0.126320 0.735218 O\n0.996266 0.625722 0.209872 O\n0.992619 0.622899 0.715842 O\n0.194036 0.156336 0.022724 O\n0.219186 0.141575 0.539079 O\n0.226053 0.628816 0.048945 O\n0.227167 0.633645 0.538729 O\n0.758195 0.125677 0.036046 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H\n0.877999 0.796657 0.758153 H\n0.122001 0.203343 0.258153 H\n0.667584 0.357422 0.358224 H\n0.332416 0.642578 0.858224 H\n0.832416 0.857422 0.858224 H\n0.167584 0.142578 0.358224 H\n0.730547 0.198510 0.539288 H\n0.269453 0.801490 0.039288 H\n0.769453 0.698510 0.039288 H\n0.230547 0.301490 0.539288 H\n0.752876 0.198182 0.406860 H\n0.247124 0.801818 0.906860 H\n0.747124 0.698182 0.906860 H\n0.252876 0.301818 0.406860 H\n0.504127 0.282504 0.034246 H\n0.495873 0.717496 0.534246 H\n0.995873 0.782504 0.534246 H\n0.004127 0.217496 0.034246 H\n0.484215 0.289258 0.901792 H\n0.515785 0.710742 0.401792 H\n0.015785 0.789258 0.401792 H\n0.984215 0.210742 0.901792 H\n0.616093 0.180270 0.759865 H\n0.383907 0.819730 0.259865 H\n0.883907 0.680270 0.259865 H\n0.116093 0.319730 0.759865 H\n0.575788 0.119379 0.862244 H\n0.424212 0.880621 0.362244 H\n0.924212 0.619379 0.362244 H\n0.075788 0.380621 0.862244 H\n0.483720 0.421057 0.378351 H\n0.516280 0.578943 0.878351 H\n0.016280 0.921057 0.878351 H\n0.983720 0.078943 0.378351 H\n0.551411 0.449672 0.253333 H\n0.448589 0.550328 0.753333 H\n0.948589 0.949672 0.753333 H\n0.051411 0.050328 0.253333 H\n0.451984 0.367108 0.253421 H\n0.548016 0.632892 0.753421 H\n0.048016 0.867108 0.753421 H\n0.951984 0.132892 0.253421 H\n0.675058 0.058379 0.382758 H\n0.324942 0.941621 0.882758 H\n0.824942 0.558379 0.882758 H\n0.175058 0.441621 0.382758 H\n0.776906 0.054168 0.487112 H\n0.223094 0.945832 0.987112 H\n0.723094 0.554168 0.987112 H\n0.276906 0.445832 0.487112 H\n0.637832 0.057807 0.523859 H\n0.362168 0.942193 0.023859 H\n0.862168 0.557807 0.023859 H\n0.137832 0.442193 0.523859 H\n0.573438 0.428093 0.893671 H\n0.426562 0.571907 0.393671 H\n0.926562 0.928093 0.393671 H\n0.073438 0.071907 0.893671 H\n0.460826 0.430007 0.986860 H\n0.539174 0.569993 0.486860 H\n0.039174 0.930007 0.486860 H\n0.960826 0.069993 0.986860 H\n0.594956 0.421084 0.038251 H\n0.405044 0.578916 0.538251 H\n0.905044 0.921084 0.538251 H\n0.094956 0.078916 0.038251 H\n0.758185 0.059840 0.882132 H\n0.241815 0.940160 0.382132 H\n0.741815 0.559840 0.382132 H\n0.258185 0.440160 0.882132 H\n0.696194 0.032739 0.753665 H\n0.303806 0.967261 0.253665 H\n0.803806 0.532739 0.253665 H\n0.196194 0.467261 0.753665 H\n0.792859 0.117974 0.760535 H\n0.207141 0.882026 0.260535 H\n0.707141 0.617974 0.260535 H\n0.292859 0.382026 0.760535 H\n0.517656 0.395967 0.301212 C\n0.482344 0.604033 0.801212 C\n0.982344 0.895967 0.801212 C\n0.017656 0.104033 0.301212 C\n0.698272 0.081179 0.465131 C\n0.301728 0.918821 0.965131 C\n0.801728 0.581179 0.965131 C\n0.198272 0.418821 0.465131 C\n0.540594 0.402328 0.971037 C\n0.459406 0.597672 0.471037 C\n0.959406 0.902328 0.471037 C\n0.040594 0.097672 0.971037 C\n0.726843 0.086093 0.804424 C\n0.273157 0.913907 0.304424 C\n0.773157 0.586093 0.304424 C\n0.226843 0.413907 0.804424 C\n0.723676 0.178505 0.125750 Se\n0.276324 0.821495 0.625750 Se\n0.776324 0.678505 0.625750 Se\n0.223676 0.321495 0.125750 Se\n0.574583 0.081751 0.126864 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