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"structure_string": "K1 Cr1 F3\n1.0\n4.151717 0.000000 0.000000\n0.000000 4.151717 -0.000000\n0.000000 -0.000000 4.151577\nK Cr F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Cr\n0.000000 0.000000 0.500000 F\n0.000000 0.500000 0.000000 F\n0.500000 0.000000 0.000000 F\n",
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{
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"structure_string": "K1 Cr1 F3\n1.0\n4.151512 0.000000 0.000000\n0.000000 4.151750 0.000000\n0.000000 0.000000 4.151750\nK Cr F\n1 1 3\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Cr\n0.500000 0.000000 0.000000 F\n0.000000 0.000000 0.500000 F\n0.000000 0.500000 0.000000 F\n",
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{
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"structure_string": "Li4 Mn1 Fe3 B4 O12\n1.0\n5.188420 -0.133420 -0.005278\n-0.088036 5.829343 1.064005\n-0.210273 -0.199756 7.722181\nLi Mn Fe B O\n4 1 3 4 12\ndirect\n0.587510 0.891929 0.810841 Li\n0.912302 0.607707 0.687911 Li\n0.083247 0.373509 0.310170 Li\n0.415076 0.122344 0.190833 Li\n0.084390 0.087542 0.672925 Mn\n0.422458 0.420588 0.830127 Fe\n0.892636 0.884038 0.314166 Fe\n0.603838 0.600518 0.178359 Fe\n0.098354 0.738787 -0.002355 B\n0.588838 0.258429 0.499826 B\n0.398636 0.757477 0.499387 B\n0.914097 0.248049 0.003442 B\n0.052281 0.137488 0.143822 O\n0.363540 0.726887 0.983281 O\n0.946117 0.836325 0.859976 O\n0.038983 0.342613 0.849044 O\n0.134018 0.774632 0.512562 O\n0.547586 0.661478 0.640215 O\n0.516520 0.853080 0.343273 O\n0.471200 0.165954 0.658241 O\n0.442255 0.356773 0.358428 O\n0.851584 0.243922 0.485168 O\n0.984649 0.638436 0.154220 O\n0.649882 0.271477 0.016143 O\n",
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"structure_string": "Mo2 H4 O8\n1.0\n3.701450 -0.019886 -0.144190\n1.453790 6.258307 -0.170138\n0.915361 2.694504 6.664478\nMo H O\n2 4 8\ndirect\n0.224155 0.154228 0.793258 Mo\n0.775845 0.845771 0.206742 Mo\n0.522149 0.766393 0.677876 H\n0.220541 0.669353 0.838658 H\n0.779459 0.330647 0.161342 H\n0.477851 0.233606 0.322124 H\n0.252635 0.247137 0.540018 O\n0.747365 0.752862 0.459982 O\n0.252938 0.935406 0.131372 O\n0.747062 0.064593 0.868628 O\n0.114965 0.402854 0.840723 O\n0.885035 0.597145 0.159277 O\n0.364199 0.791936 0.788736 O\n0.635801 0.208063 0.211264 O\n",
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"structure_string": "Ba2 Cl1\n1.0\n4.223252 0.571267 -0.382376\n0.530715 -4.207954 -0.562061\n-0.864016 0.970094 -8.083315\nBa Cl\n2 1\ndirect\n0.123535 0.463193 0.314301 Ba\n0.623431 0.963264 0.740038 Ba\n0.123598 0.963301 0.027172 Cl\n",
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"structure_string": "Mo2 H4 O8\n1.0\n3.697273 -0.059734 -0.227990\n1.519214 6.242075 -0.221294\n1.107382 2.712305 6.633444\nMo H O\n2 4 8\ndirect\n0.232213 0.148190 0.792003 Mo\n0.782853 0.839590 0.205502 Mo\n0.485132 0.227552 0.320584 H\n0.529934 0.760235 0.676920 H\n0.228390 0.663239 0.838002 H\n0.786695 0.324540 0.159508 H\n0.261294 0.241081 0.538783 O\n0.753754 0.746694 0.458723 O\n0.260136 0.929251 0.130116 O\n0.754935 0.058532 0.867390 O\n0.122648 0.396926 0.839155 O\n0.892434 0.590857 0.158348 O\n0.372548 0.785635 0.788026 O\n0.642546 0.202140 0.209491 O\n",
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