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{
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{
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{
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{
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"structure_string": "Pa1 O1\n1.0\n0.000000 2.468952 2.468952\n2.468952 0.000000 2.468952\n2.468952 2.468952 0.000000\nPa O\n1 1\ndirect\n0.500000 0.500000 0.500000 Pa\n0.000000 0.000000 0.000000 O\n",
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{
"id": "mp-1185655",
"created_at": "2022-09-04T14:40:21.698584Z",
"structure_string": "Mg149 Zr1\n1.0\n13.786960 -7.959908 -0.000000\n0.000000 15.919819 0.000000\n0.000000 0.000000 15.598440\nMg Zr\n149 1\ndirect\n0.601405 0.000144 -0.000000 Mg\n0.398740 0.000145 -0.000000 Mg\n0.197298 0.198826 -0.000000 Mg\n0.001529 0.198826 -0.000000 Mg\n0.599790 0.199580 -0.000000 Mg\n0.799636 0.200364 -0.000000 Mg\n0.400728 0.200364 -0.000000 Mg\n0.999855 0.398595 -0.000000 Mg\n0.398740 0.398595 -0.000000 Mg\n0.599790 0.400209 -0.000000 Mg\n0.800420 0.400209 -0.000000 Mg\n0.200560 0.401119 -0.000000 Mg\n0.799636 0.599272 -0.000000 Mg\n0.199987 0.599994 -0.000000 Mg\n0.400006 0.599994 -0.000000 Mg\n0.601405 0.601261 -0.000000 Mg\n0.999855 0.601261 -0.000000 Mg\n0.598882 0.799440 -0.000000 Mg\n0.200560 0.799440 -0.000000 Mg\n0.400006 0.800013 -0.000000 Mg\n0.001529 0.802703 -0.000000 Mg\n0.801174 0.802703 -0.000000 Mg\n0.197298 0.998471 -0.000000 Mg\n0.801174 0.998471 -0.000000 Mg\n0.066059 0.132119 0.164656 Mg\n0.066059 0.933940 0.164656 Mg\n0.867881 0.933940 0.164656 Mg\n0.265325 0.132662 0.165239 Mg\n0.867338 0.132662 0.165239 Mg\n0.867338 0.734675 0.165239 Mg\n0.666667 0.333333 0.166207 Mg\n0.465877 0.133078 0.166624 Mg\n0.667202 0.133078 0.166624 Mg\n0.866922 0.332798 0.166624 Mg\n0.465877 0.332798 0.166624 Mg\n0.866922 0.534123 0.166624 Mg\n0.667202 0.534123 0.166624 Mg\n0.066676 0.533338 0.166742 Mg\n0.466662 0.533338 0.166742 Mg\n0.466662 0.933324 0.166742 Mg\n0.266775 0.334393 0.167035 Mg\n0.067618 0.334393 0.167035 Mg\n0.067618 0.733225 0.167035 Mg\n0.665607 0.733225 0.167035 Mg\n0.665607 0.932382 0.167035 Mg\n0.266775 0.932383 0.167035 Mg\n0.266943 0.533885 0.167081 Mg\n0.466115 0.733057 0.167081 Mg\n0.266943 0.733057 0.167081 Mg\n0.800059 0.999823 0.332245 Mg\n0.199764 0.999824 0.332245 Mg\n0.199764 0.199941 0.332245 Mg\n0.000177 0.199941 0.332245 Mg\n0.000177 0.800236 0.332245 Mg\n0.800059 0.800236 0.332245 Mg\n0.599969 0.199940 0.333014 Mg\n0.599969 0.400030 0.333014 Mg\n0.800061 0.400031 0.333014 Mg\n0.800067 0.199933 0.333189 Mg\n0.399866 0.199933 0.333189 Mg\n0.800067 0.600134 0.333189 Mg\n0.400032 0.000093 0.333322 Mg\n0.600060 0.000093 0.333322 Mg\n0.999907 0.399939 0.333322 Mg\n0.400032 0.399940 0.333322 Mg\n0.600060 0.599968 0.333322 Mg\n0.999907 0.599969 0.333322 Mg\n0.199901 0.599951 0.333744 Mg\n0.400049 0.599951 0.333744 Mg\n0.400049 0.800099 0.333744 Mg\n0.200258 0.400516 0.333956 Mg\n0.599485 0.799742 0.333956 Mg\n0.200258 0.799742 0.333956 Mg\n-0.000000 0.000000 0.334217 Mg\n0.266487 0.133244 0.500000 Mg\n0.866756 0.133244 0.500000 Mg\n0.066743 0.133487 0.500000 Mg\n0.466993 0.134200 0.500000 Mg\n0.667207 0.134200 0.500000 Mg\n0.466993 0.332793 0.500000 Mg\n0.865800 0.332793 0.500000 Mg\n0.066515 0.333086 0.500000 Mg\n0.266571 0.333086 0.500000 Mg\n0.666667 0.333333 0.500000 Mg\n0.865800 0.533007 0.500000 Mg\n0.667207 0.533007 0.500000 Mg\n0.065776 0.532888 0.500000 Mg\n0.467112 0.532888 0.500000 Mg\n0.266539 0.533079 0.500000 Mg\n0.666915 0.733429 0.500000 Mg\n0.066515 0.733429 0.500000 Mg\n0.466921 0.733460 0.500000 Mg\n0.266539 0.733461 0.500000 Mg\n0.866756 0.733513 0.500000 Mg\n0.866512 0.933256 0.500000 Mg\n0.066743 0.933257 0.500000 Mg\n0.266571 0.933485 0.500000 Mg\n0.666915 0.933486 0.500000 Mg\n0.467112 0.934224 0.500000 Mg\n-0.000000 0.000000 0.665783 Mg\n0.200258 0.400516 0.666044 Mg\n0.599485 0.799742 0.666044 Mg\n0.200258 0.799742 0.666044 Mg\n0.199901 0.599951 0.666256 Mg\n0.400049 0.599951 0.666256 Mg\n0.400049 0.800099 0.666256 Mg\n0.400032 0.000093 0.666678 Mg\n0.600060 0.000093 0.666678 Mg\n0.999907 0.399939 0.666678 Mg\n0.400032 0.399940 0.666678 Mg\n0.600060 0.599968 0.666678 Mg\n0.999907 0.599969 0.666678 Mg\n0.800067 0.199933 0.666811 Mg\n0.399866 0.199933 0.666811 Mg\n0.800067 0.600134 0.666811 Mg\n0.599969 0.199940 0.666986 Mg\n0.599969 0.400030 0.666986 Mg\n0.800061 0.400031 0.666986 Mg\n0.800059 0.999823 0.667755 Mg\n0.199764 0.999824 0.667755 Mg\n0.199764 0.199941 0.667755 Mg\n0.000177 0.199941 0.667755 Mg\n0.000177 0.800236 0.667755 Mg\n0.800059 0.800236 0.667755 Mg\n0.266943 0.533885 0.832919 Mg\n0.466115 0.733057 0.832919 Mg\n0.266943 0.733057 0.832919 Mg\n0.266775 0.334393 0.832964 Mg\n0.067618 0.334393 0.832964 Mg\n0.067618 0.733225 0.832964 Mg\n0.665607 0.733225 0.832964 Mg\n0.665607 0.932382 0.832964 Mg\n0.266775 0.932383 0.832964 Mg\n0.066676 0.533338 0.833258 Mg\n0.466662 0.533338 0.833258 Mg\n0.466662 0.933324 0.833258 Mg\n0.465877 0.133078 0.833376 Mg\n0.667202 0.133078 0.833376 Mg\n0.866922 0.332798 0.833376 Mg\n0.465877 0.332798 0.833376 Mg\n0.866922 0.534123 0.833376 Mg\n0.667202 0.534123 0.833376 Mg\n0.666667 0.333333 0.833793 Mg\n0.265325 0.132662 0.834761 Mg\n0.867338 0.132662 0.834761 Mg\n0.867338 0.734675 0.834761 Mg\n0.066059 0.132119 0.835344 Mg\n0.066059 0.933940 0.835344 Mg\n0.867881 0.933940 0.835344 Mg\n-0.000000 0.000000 -0.000000 Zr\n",
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"volume": 3423.6377630436386,
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"formula_full": "Mg149 Zr1",
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"spacegroup": 187
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{
"id": "mp-1183830",
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"structure_string": "Dy5 Mg1\n1.0\n1.787036 -9.167847 0.000000\n1.787036 9.167847 0.000000\n0.000000 0.000000 5.591788\nDy Mg\n5 1\ndirect\n0.001232 0.998768 0.500000 Dy\n0.671059 0.328941 0.500000 Dy\n0.332761 0.667239 0.500000 Dy\n0.553865 0.446135 0.000000 Dy\n0.885648 0.114352 0.000000 Dy\n0.222108 0.777892 0.000000 Mg\n",
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{
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{
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