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"spacegroup": 55
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{
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"structure_string": "Li4 Ti3 Mn2 Fe3 O16\n1.0\n2.953437 5.187335 0.000000\n-2.953437 5.187335 0.000000\n0.000000 0.350066 9.591464\nLi Ti Mn Fe O\n4 3 2 3 16\ndirect\n0.667768 0.667768 0.107426 Li\n0.988185 0.988185 0.011110 Li\n0.997470 0.997470 0.501709 Li\n0.334012 0.334012 0.600305 Li\n0.331670 0.831349 0.786173 Ti\n0.831349 0.331670 0.786173 Ti\n0.176936 0.176936 0.284063 Ti\n0.669314 0.669314 0.513811 Mn\n0.337657 0.337657 0.017097 Mn\n0.827303 0.827303 0.785506 Fe\n0.181044 0.662637 0.289849 Fe\n0.662637 0.181044 0.289849 Fe\n0.341705 0.837291 0.403912 O\n0.521002 0.521002 0.658079 O\n0.655686 0.655686 0.894049 O\n0.999933 0.999933 0.687216 O\n0.009648 0.009648 0.197517 O\n0.837291 0.341705 0.403912 O\n0.515053 0.954533 0.656017 O\n0.954533 0.515053 0.656017 O\n0.153803 0.153803 0.888682 O\n0.833236 0.833236 0.404735 O\n0.045404 0.478177 0.156181 O\n0.478177 0.045404 0.156181 O\n0.326257 0.326257 0.398401 O\n0.166017 0.666835 0.896044 O\n0.489609 0.489609 0.166105 O\n0.666835 0.166017 0.896044 O\n",
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{
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"structure_string": "Li8 Ti2 Mn8 Fe8 O36\n1.0\n2.906708 0.000000 0.000000\n0.000000 9.035782 0.000000\n0.000000 0.000000 24.557454\nLi Ti Mn Fe O\n8 2 8 8 36\ndirect\n0.000000 0.924697 0.995043 Li\n0.000000 0.950463 0.206554 Li\n0.000000 0.049537 0.706554 Li\n0.000000 0.075303 0.495043 Li\n0.000000 0.439825 0.519811 Li\n0.000000 0.441089 0.297881 Li\n0.000000 0.558911 0.797881 Li\n0.000000 0.560175 0.019811 Li\n0.000000 0.257851 0.398068 Ti\n0.000000 0.742149 0.898068 Ti\n0.000000 0.750318 0.500752 Mn\n0.000000 0.761043 0.105749 Mn\n0.500000 0.901589 0.806479 Mn\n0.500000 0.098411 0.306479 Mn\n0.000000 0.238957 0.605749 Mn\n0.000000 0.249682 0.000752 Mn\n0.500000 0.403915 0.691008 Mn\n0.500000 0.596085 0.191008 Mn\n0.000000 0.760883 0.307308 Fe\n0.500000 0.900895 0.585449 Fe\n0.500000 0.099105 0.085449 Fe\n0.000000 0.239117 0.807308 Fe\n0.000000 0.254937 0.188473 Fe\n0.500000 0.394506 0.914457 Fe\n0.500000 0.605494 0.414457 Fe\n0.000000 0.745063 0.688473 Fe\n0.000000 0.744181 0.422859 O\n0.000000 0.758429 0.579460 O\n0.500000 0.804875 0.942932 O\n0.500000 0.798443 0.159417 O\n0.500000 0.878016 0.663590 O\n0.000000 0.854553 0.757827 O\n0.500000 0.893344 0.504420 O\n0.500000 0.896036 0.279604 O\n0.000000 0.942130 0.855193 O\n0.000000 0.956367 0.079630 O\n0.000000 0.043633 0.579630 O\n0.000000 0.057870 0.355193 O\n0.500000 0.103964 0.779604 O\n0.500000 0.106656 0.004420 O\n0.000000 0.145447 0.257827 O\n0.500000 0.121984 0.163590 O\n0.500000 0.201557 0.659417 O\n0.500000 0.195125 0.442932 O\n0.000000 0.241571 0.079460 O\n0.000000 0.255819 0.922859 O\n0.500000 0.295802 0.558625 O\n0.500000 0.295427 0.339022 O\n0.500000 0.365108 0.836413 O\n0.000000 0.361725 0.740309 O\n0.500000 0.395869 0.996308 O\n0.500000 0.392950 0.212545 O\n0.000000 0.436001 0.640567 O\n0.000000 0.459257 0.414418 O\n0.000000 0.540743 0.914418 O\n0.000000 0.563999 0.140567 O\n0.500000 0.607050 0.712545 O\n0.500000 0.604131 0.496308 O\n0.000000 0.638275 0.240309 O\n0.500000 0.634892 0.336413 O\n0.500000 0.704573 0.839022 O\n0.500000 0.704198 0.058625 O\n",
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{
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"structure_string": "Li8 Ti4 Mn6 Fe8 O36\n1.0\n2.935200 0.000000 0.000000\n0.000000 8.997828 0.000000\n0.000000 0.000000 25.460821\nLi Ti Mn Fe O\n8 4 6 8 36\ndirect\n0.000000 0.193112 0.989227 Li\n0.000000 0.197569 0.205029 Li\n0.000000 0.302431 0.705029 Li\n0.000000 0.306888 0.489227 Li\n0.000000 0.693112 0.510773 Li\n0.000000 0.697569 0.294971 Li\n0.000000 0.802431 0.794971 Li\n0.000000 0.806888 0.010773 Li\n0.000000 0.002941 0.101867 Ti\n0.000000 0.497059 0.601867 Ti\n0.000000 0.502941 0.398133 Ti\n0.000000 0.997059 0.898133 Ti\n0.000000 0.000000 0.500000 Mn\n0.500000 0.146223 0.807235 Mn\n0.500000 0.353777 0.307235 Mn\n0.000000 0.500000 0.000000 Mn\n0.500000 0.646223 0.692765 Mn\n0.500000 0.853777 0.192765 Mn\n0.000000 0.020691 0.304106 Fe\n0.500000 0.138898 0.589030 Fe\n0.500000 0.361102 0.089030 Fe\n0.000000 0.479309 0.804106 Fe\n0.000000 0.520691 0.195894 Fe\n0.500000 0.638898 0.910970 Fe\n0.500000 0.861102 0.410970 Fe\n0.000000 0.979309 0.695894 Fe\n0.000000 0.003308 0.424938 O\n0.000000 0.996692 0.575062 O\n0.500000 0.062733 0.940786 O\n0.500000 0.046391 0.158346 O\n0.500000 0.101987 0.665919 O\n0.000000 0.096594 0.760401 O\n0.500000 0.144550 0.504998 O\n0.500000 0.154749 0.278322 O\n0.000000 0.192646 0.853494 O\n0.000000 0.203059 0.084058 O\n0.000000 0.296941 0.584058 O\n0.000000 0.307354 0.353494 O\n0.500000 0.345251 0.778322 O\n0.500000 0.355450 0.004998 O\n0.000000 0.403406 0.260401 O\n0.500000 0.398013 0.165919 O\n0.500000 0.453609 0.658346 O\n0.500000 0.437267 0.440786 O\n0.000000 0.503308 0.075062 O\n0.000000 0.496692 0.924938 O\n0.500000 0.562733 0.559214 O\n0.500000 0.546391 0.341654 O\n0.500000 0.601987 0.834081 O\n0.000000 0.596594 0.739599 O\n0.500000 0.644550 0.995002 O\n0.500000 0.654749 0.221678 O\n0.000000 0.692646 0.646506 O\n0.000000 0.703059 0.415942 O\n0.000000 0.796941 0.915942 O\n0.000000 0.807354 0.146506 O\n0.500000 0.845251 0.721678 O\n0.500000 0.855450 0.495002 O\n0.000000 0.903406 0.239599 O\n0.500000 0.898013 0.334081 O\n0.500000 0.953609 0.841654 O\n0.500000 0.937267 0.059214 O\n",
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{
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"structure_string": "Li8 Ti6 Mn4 Fe8 O36\n1.0\n2.939695 0.000000 0.000000\n0.000000 9.065354 0.000000\n0.000000 0.000000 25.330793\nLi Ti Mn Fe O\n8 6 4 8 36\ndirect\n0.000000 0.945926 0.991082 Li\n0.000000 0.944770 0.203420 Li\n0.000000 0.055230 0.703420 Li\n0.000000 0.054074 0.491082 Li\n0.000000 0.442630 0.512464 Li\n0.000000 0.448631 0.303765 Li\n0.000000 0.551369 0.803765 Li\n0.000000 0.557370 0.012464 Li\n0.000000 0.756399 0.100354 Ti\n0.000000 0.243601 0.600354 Ti\n0.000000 0.251059 0.399090 Ti\n0.500000 0.399081 0.691608 Ti\n0.500000 0.600919 0.191608 Ti\n0.000000 0.748941 0.899090 Ti\n0.000000 0.747971 0.500156 Mn\n0.500000 0.896697 0.807726 Mn\n0.500000 0.103303 0.307726 Mn\n0.000000 0.252029 0.000156 Mn\n0.000000 0.769195 0.305975 Fe\n0.500000 0.891052 0.588666 Fe\n0.500000 0.108948 0.088666 Fe\n0.000000 0.230805 0.805975 Fe\n0.000000 0.262156 0.195213 Fe\n0.500000 0.392405 0.911300 Fe\n0.500000 0.607595 0.411300 Fe\n0.000000 0.737844 0.695213 Fe\n0.000000 0.750411 0.424252 O\n0.000000 0.746994 0.576092 O\n0.500000 0.814508 0.941625 O\n0.500000 0.801498 0.156274 O\n0.500000 0.862838 0.666391 O\n0.000000 0.850158 0.760683 O\n0.500000 0.890853 0.503973 O\n0.500000 0.903497 0.281240 O\n0.000000 0.940630 0.854588 O\n0.000000 0.954576 0.080026 O\n0.000000 0.045424 0.580026 O\n0.000000 0.059370 0.354588 O\n0.500000 0.096503 0.781240 O\n0.500000 0.109147 0.003973 O\n0.000000 0.149842 0.260683 O\n0.500000 0.137162 0.166391 O\n0.500000 0.198502 0.656274 O\n0.500000 0.185492 0.441625 O\n0.000000 0.253006 0.076092 O\n0.000000 0.249589 0.924252 O\n0.500000 0.310040 0.556821 O\n0.500000 0.297207 0.341264 O\n0.500000 0.360519 0.833773 O\n0.000000 0.340957 0.739605 O\n0.500000 0.395875 0.995816 O\n0.500000 0.399259 0.217372 O\n0.000000 0.438207 0.643287 O\n0.000000 0.451081 0.416098 O\n0.000000 0.548919 0.916098 O\n0.000000 0.561793 0.143287 O\n0.500000 0.600741 0.717372 O\n0.500000 0.604125 0.495816 O\n0.000000 0.659043 0.239605 O\n0.500000 0.639481 0.333773 O\n0.500000 0.702793 0.841264 O\n0.500000 0.689960 0.056821 O\n",
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{
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{
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}