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{
"id": "mp-1195936",
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"structure_string": "K4 Ir4 N4 Cl20 O8\n1.0\n0.000000 0.000000 -6.231755\n0.000000 -7.198915 0.000000\n-23.055281 0.000000 0.000000\nK Ir N Cl O\n4 4 4 20 8\ndirect\n0.487235 0.750000 0.176966 K\n0.012765 0.750000 0.676966 K\n0.512765 0.250000 0.823034 K\n0.987235 0.250000 0.323034 K\n0.614778 0.750000 0.373829 Ir\n0.885222 0.750000 0.873829 Ir\n0.385222 0.250000 0.626171 Ir\n0.114778 0.250000 0.126171 Ir\n0.373961 0.750000 0.415406 N\n0.126039 0.750000 0.915406 N\n0.626039 0.250000 0.584594 N\n0.873961 0.250000 0.084594 N\n0.497027 0.982937 0.307794 Cl\n0.002973 0.517063 0.807794 Cl\n0.502973 0.482937 0.692206 Cl\n0.997027 0.017063 0.192206 Cl\n0.502973 0.017063 0.692206 Cl\n0.997027 0.482937 0.192206 Cl\n0.497027 0.517063 0.307794 Cl\n0.002973 0.982937 0.807794 Cl\n0.757372 0.985254 0.434482 Cl\n0.742628 0.514746 0.934482 Cl\n0.242628 0.485254 0.565518 Cl\n0.257372 0.014746 0.065518 Cl\n0.242628 0.014746 0.565518 Cl\n0.257372 0.485254 0.065518 Cl\n0.757372 0.514746 0.434482 Cl\n0.742628 0.985254 0.934482 Cl\n0.936050 0.750000 0.325015 Cl\n0.563950 0.750000 0.825015 Cl\n0.063950 0.250000 0.674985 Cl\n0.436050 0.250000 0.174985 Cl\n0.228946 0.750000 0.446202 O\n0.271054 0.750000 0.946202 O\n0.771054 0.250000 0.553798 O\n0.728946 0.250000 0.053798 O\n0.755329 0.750000 0.079428 O\n0.744671 0.750000 0.579428 O\n0.244671 0.250000 0.920572 O\n0.255329 0.250000 0.420572 O\n",
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{
"id": "mp-1229216",
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"structure_string": "Ce4 Nb12 O36\n1.0\n3.950883 8.987156 0.000000\n-3.950883 8.987156 0.000000\n0.000000 3.629525 10.736320\nCe Nb O\n4 12 36\ndirect\n0.500000 0.500000 0.000000 Ce\n0.000000 0.000000 0.000000 Ce\n0.668702 0.668702 0.661857 Ce\n0.331298 0.331298 0.338143 Ce\n0.584421 0.084278 0.583990 Nb\n0.924674 0.418043 0.915989 Nb\n0.249573 0.756360 0.257951 Nb\n0.915722 0.415579 0.416010 Nb\n0.243640 0.750427 0.742049 Nb\n0.581957 0.075326 0.084011 Nb\n0.750427 0.243640 0.742049 Nb\n0.075326 0.581957 0.084011 Nb\n0.415579 0.915722 0.416010 Nb\n0.756360 0.249573 0.257951 Nb\n0.084278 0.584421 0.583990 Nb\n0.418043 0.924674 0.915989 Nb\n0.665742 0.166247 0.665988 O\n0.000000 0.500000 0.000000 O\n0.334258 0.833753 0.334012 O\n0.833753 0.334258 0.334012 O\n0.166247 0.665742 0.665988 O\n0.500000 0.000000 0.000000 O\n0.820849 0.336122 0.843260 O\n0.179151 0.663878 0.156740 O\n0.500000 0.000000 0.500000 O\n0.663878 0.179151 0.156740 O\n0.000000 0.500000 0.500000 O\n0.336122 0.820849 0.843260 O\n0.823533 0.823533 0.578716 O\n0.156948 0.156948 0.913218 O\n0.491338 0.491338 0.233688 O\n0.994315 0.994315 0.237806 O\n0.326909 0.326909 0.571857 O\n0.653186 0.653186 0.910586 O\n0.005685 0.005685 0.762194 O\n0.346814 0.346814 0.089414 O\n0.673091 0.673091 0.428143 O\n0.176467 0.176467 0.421284 O\n0.508662 0.508662 0.766312 O\n0.843052 0.843052 0.086782 O\n0.829313 0.322207 0.076648 O\n0.512283 0.976713 0.746564 O\n0.180413 0.644533 0.410106 O\n0.322207 0.829313 0.076648 O\n0.976713 0.512283 0.746564 O\n0.644533 0.180413 0.410106 O\n0.487717 0.023287 0.253436 O\n0.170687 0.677793 0.923352 O\n0.819587 0.355467 0.589894 O\n0.023287 0.487717 0.253436 O\n0.677793 0.170687 0.923352 O\n0.355467 0.819587 0.589894 O\n",
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{
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"created_at": "2022-09-04T14:45:25.697043Z",
"structure_string": "Mn1 Fe5 P6 O24\n1.0\n7.237709 -4.332664 0.000000\n7.237709 4.332664 0.000000\n4.644073 0.000000 7.041945\nMn Fe P O\n1 5 6 24\ndirect\n0.854913 0.854913 0.854913 Mn\n0.000852 0.000852 0.000852 Fe\n0.353966 0.353966 0.353966 Fe\n0.499494 0.499494 0.499494 Fe\n0.146276 0.146276 0.146276 Fe\n0.645674 0.645674 0.645674 Fe\n0.749075 0.046303 0.453253 P\n0.046303 0.453253 0.749075 P\n0.453253 0.749075 0.046303 P\n0.547686 0.248792 0.953609 P\n0.953609 0.547686 0.248792 P\n0.248792 0.953609 0.547686 P\n0.893992 0.497551 0.672332 O\n0.497551 0.672332 0.893992 O\n0.672332 0.893992 0.497551 O\n0.906092 0.056608 0.251997 O\n0.821446 0.008392 0.605691 O\n0.595578 0.250968 0.435574 O\n0.056608 0.251997 0.906092 O\n0.250968 0.435574 0.595578 O\n0.393024 0.175192 0.998728 O\n0.435574 0.595578 0.250968 O\n0.750285 0.095775 0.941509 O\n0.998728 0.393024 0.175192 O\n0.008392 0.605691 0.821446 O\n0.251997 0.906092 0.056608 O\n0.561167 0.402898 0.750383 O\n0.605691 0.821446 0.008392 O\n0.750383 0.561167 0.402898 O\n0.941509 0.750285 0.095775 O\n0.402898 0.750383 0.561167 O\n0.175192 0.998728 0.393024 O\n0.095775 0.941509 0.750285 O\n0.321059 0.109512 0.504356 O\n0.504356 0.321059 0.109512 O\n0.109512 0.504356 0.321059 O\n",
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"formula_full": "Mn1 Fe5 P6 O24",
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{
"id": "mp-1184542",
"created_at": "2022-09-04T14:45:25.702844Z",
"structure_string": "Eu6 Ga10\n1.0\n2.313535 -5.492466 0.000000\n2.313535 5.492466 0.000000\n0.000000 0.000000 15.099313\nEu Ga\n6 10\ndirect\n0.874302 0.125698 0.750000 Eu\n0.125698 0.874302 0.250000 Eu\n0.592335 0.407665 0.892809 Eu\n0.592335 0.407665 0.607191 Eu\n0.407665 0.592335 0.392809 Eu\n0.407665 0.592335 0.107191 Eu\n0.168106 0.831894 0.750000 Ga\n0.831894 0.168106 0.250000 Ga\n0.115222 0.884778 0.033766 Ga\n0.115222 0.884778 0.466234 Ga\n0.706924 0.293076 0.098137 Ga\n0.706924 0.293076 0.401863 Ga\n0.293076 0.706924 0.901863 Ga\n0.293076 0.706924 0.598137 Ga\n0.884778 0.115222 0.966234 Ga\n0.884778 0.115222 0.533766 Ga\n",
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{
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"structure_string": "Fe10 O6 F14\n1.0\n4.796813 0.000000 0.000000\n0.000000 4.810599 0.000000\n0.000000 0.000000 15.680161\nFe O F\n10 6 14\ndirect\n0.009335 0.752146 0.904786 Fe\n0.009335 0.752146 0.095214 Fe\n0.979336 0.709606 0.291028 Fe\n0.030909 0.780860 0.500000 Fe\n0.979336 0.709606 0.708972 Fe\n0.530909 0.219140 0.000000 Fe\n0.509335 0.247854 0.404786 Fe\n0.479336 0.290394 0.208972 Fe\n0.509335 0.247854 0.595214 Fe\n0.479336 0.290394 0.791028 Fe\n0.185146 0.559691 0.198604 O\n0.185146 0.559691 0.801396 O\n0.685146 0.440309 0.301396 O\n0.685146 0.440309 0.698604 O\n0.318283 0.071704 0.500000 O\n0.818283 0.928296 0.000000 O\n0.219817 0.524547 0.000000 F\n0.196064 0.552866 0.392751 F\n0.196064 0.552866 0.607249 F\n0.696064 0.447134 0.892751 F\n0.696064 0.447134 0.107249 F\n0.719817 0.475453 0.500000 F\n0.308105 0.057279 0.890862 F\n0.308105 0.057279 0.109138 F\n0.287508 0.044071 0.298814 F\n0.287508 0.044071 0.701186 F\n0.808105 0.942721 0.390862 F\n0.787508 0.955929 0.201186 F\n0.787508 0.955929 0.798814 F\n0.808105 0.942721 0.609138 F\n",
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{
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"structure_string": "Yb12 S18\n1.0\n3.693161 -6.395258 0.000000\n3.693161 6.395258 0.000000\n0.000000 0.000000 15.314419\nYb S\n12 18\ndirect\n0.978770 0.978770 0.449071 Yb\n0.021230 0.021230 0.949071 Yb\n0.103023 0.103023 0.214154 Yb\n0.896977 0.896977 0.714154 Yb\n0.627671 0.347845 0.540930 Yb\n0.347845 0.627671 0.540930 Yb\n0.372329 0.652155 0.040930 Yb\n0.652155 0.372329 0.040930 Yb\n0.658465 0.336881 0.295332 Yb\n0.336881 0.658465 0.295332 Yb\n0.341535 0.663119 0.795332 Yb\n0.663119 0.341535 0.795332 Yb\n0.605551 0.605551 0.410191 S\n0.297639 0.989800 0.357630 S\n0.989800 0.297639 0.357630 S\n0.394449 0.394449 0.910191 S\n0.702361 0.010200 0.857630 S\n0.010200 0.702361 0.857630 S\n0.804048 0.804048 0.102684 S\n0.289611 0.979466 0.069090 S\n0.979466 0.289611 0.069090 S\n0.195952 0.195952 0.602684 S\n0.710389 0.020534 0.569090 S\n0.020534 0.710389 0.569090 S\n0.463142 0.463142 0.176895 S\n0.509410 0.996929 0.157021 S\n0.996929 0.509410 0.157021 S\n0.536858 0.536858 0.676895 S\n0.490590 0.003071 0.657021 S\n0.003071 0.490590 0.657021 S\n",
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{
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{
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"structure_string": "Hf5 Zr5 Ga6\n1.0\n4.044083 -6.970568 0.000000\n4.044083 6.970568 0.000000\n0.000000 0.000000 5.732826\nHf Zr Ga\n5 5 6\ndirect\n0.333085 0.666570 0.250055 Hf\n0.666570 0.333085 0.250055 Hf\n0.666570 0.333085 0.749945 Hf\n0.333085 0.666570 0.749945 Hf\n0.245963 0.245963 0.500000 Hf\n0.757352 0.999545 0.500000 Zr\n0.999545 0.757352 0.500000 Zr\n0.754699 0.754699 0.000000 Zr\n0.242890 0.000892 0.000000 Zr\n0.000892 0.242890 0.000000 Zr\n0.606606 0.606606 0.500000 Ga\n0.391995 0.000920 0.500000 Ga\n0.000920 0.391995 0.500000 Ga\n0.392614 0.392614 0.000000 Ga\n0.607512 0.999745 0.000000 Ga\n0.999745 0.607512 0.000000 Ga\n",
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{
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