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"structure_string": "Tl1 Cd1 N3 O6\n1.0\n5.380294 -0.019689 -0.059917\n-0.060369 5.379991 -0.059917\n-0.019540 -0.019689 5.380592\nTl Cd N O\n1 1 3 6\ndirect\n0.626840 0.626840 0.626840 Tl\n0.099507 0.099507 0.099507 Cd\n0.161526 0.552184 0.114671 N\n0.552184 0.114672 0.161525 N\n0.114672 0.161526 0.552184 N\n0.669770 0.318030 0.160141 O\n0.160142 0.669770 0.318030 O\n0.919755 0.150836 0.682067 O\n0.682067 0.919755 0.150836 O\n0.150836 0.682068 0.919755 O\n0.318030 0.160142 0.669770 O\n",
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"structure_string": "Na3 Tm1 Cl6\n1.0\n6.372715 -0.000000 3.679289\n2.124238 6.008253 3.679289\n-0.000000 -0.000000 7.358577\nNa Tm Cl\n3 1 6\ndirect\n0.750000 0.750000 0.750001 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.500001 Na\n0.000000 0.000000 0.000000 Tm\n0.753210 0.246790 0.246790 Cl\n0.246790 0.246790 0.753211 Cl\n0.246790 0.753210 0.753211 Cl\n0.246790 0.753210 0.246790 Cl\n0.753210 0.246790 0.753211 Cl\n0.753210 0.753210 0.246790 Cl\n",
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"structure_string": "K2 Rb1 As1 Br6\n1.0\n7.091855 -0.000000 4.094485\n2.363952 6.686265 4.094485\n-0.000000 -0.000000 8.188969\nK Rb As Br\n2 1 1 6\ndirect\n0.750000 0.750001 0.749999 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.499999 Rb\n0.000000 0.000000 0.000000 As\n0.770942 0.229059 0.229058 Br\n0.229059 0.229059 0.770941 Br\n0.229058 0.770942 0.770941 Br\n0.229058 0.770942 0.229058 Br\n0.770942 0.229059 0.770941 Br\n0.770942 0.770942 0.229057 Br\n",
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