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"structure_string": "Li2 Ni2 C4 O12\n1.0\n0.000000 4.809918 -0.287439\n7.671212 0.000000 0.000000\n0.000000 -2.071826 -5.888796\nLi Ni C O\n2 2 4 12\ndirect\n0.649229 0.047005 0.641999 Li\n0.350771 0.547005 0.358002 Li\n0.001649 0.000305 0.244152 Ni\n-0.001649 0.500305 0.755849 Ni\n0.134552 0.260048 0.117003 C\n0.143774 0.244244 0.611228 C\n0.865448 0.760048 0.882998 C\n0.856226 0.744244 0.388772 C\n0.903953 0.255303 0.669345 O\n0.096047 0.755303 0.330656 O\n0.243032 0.102697 0.557662 O\n0.274355 0.394291 0.618996 O\n0.720349 0.616617 0.874306 O\n0.221447 0.409145 0.073518 O\n0.892630 0.235123 0.168715 O\n0.107370 0.735123 0.831286 O\n0.756968 0.602697 0.442339 O\n0.279651 0.116617 0.125694 O\n0.778553 0.909145 0.926483 O\n0.725645 0.894291 0.381005 O\n",
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{
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"structure_string": "Ba1 Al2 Si2 O8\n1.0\n2.670723 -4.625827 0.000000\n2.670723 4.625827 -0.000000\n0.000000 -0.000000 7.867780\nBa Al Si O\n1 2 2 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333332 0.666667 0.705853 Al\n0.666667 0.333332 0.294147 Al\n0.333332 0.666667 0.283514 Si\n0.666667 0.333332 0.716486 Si\n0.333332 0.666667 0.487280 O\n0.666667 0.333332 0.512720 O\n0.575138 0.563948 0.793526 O\n0.988809 0.424861 0.793526 O\n0.436052 0.011190 0.793526 O\n0.424861 0.436051 0.206474 O\n0.011190 0.575138 0.206474 O\n0.563947 0.988809 0.206474 O\n",
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"structure_string": "Mo2 Se2 Cl14 O2\n1.0\n7.087950 0.012739 -2.832361\n-2.741740 7.465648 -0.280916\n-0.109805 0.056185 9.498106\nMo Se Cl O\n2 2 14 2\ndirect\n0.167141 0.347671 0.382653 Mo\n0.832860 0.652329 0.617348 Mo\n0.503331 0.764210 0.212419 Se\n0.496669 0.235790 0.787581 Se\n0.170501 0.629936 0.299549 Cl\n0.599617 0.477684 0.366403 Cl\n0.897274 0.770240 0.864482 Cl\n0.711621 0.890001 0.528529 Cl\n0.315963 0.607232 0.976791 Cl\n0.205225 0.153715 0.807840 Cl\n0.433461 0.012490 0.173352 Cl\n0.288380 0.109998 0.471471 Cl\n0.566539 -0.012490 0.826649 Cl\n0.684037 0.392768 0.023209 Cl\n0.400383 0.522316 0.633597 Cl\n0.102727 0.229760 0.135519 Cl\n0.794776 0.846285 0.192160 Cl\n0.829500 0.370063 0.700451 Cl\n0.946272 0.280986 0.394955 O\n0.053729 0.719014 0.605045 O\n",
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"structure_string": "Mo3 W1 Se6 S2\n1.0\n3.292225 -0.000002 0.000008\n-1.646114 2.851138 0.000064\n0.000088 0.000613 34.921504\nMo W Se S\n3 1 6 2\ndirect\n0.333351 0.666633 0.096510 Mo\n0.333333 0.666698 0.468631 Mo\n0.666641 0.333320 0.279150 Mo\n0.666675 0.333352 0.658623 W\n0.333284 0.666608 0.327425 Se\n0.333344 0.666693 0.707126 Se\n0.666686 0.333403 0.420356 Se\n0.666645 0.333326 0.516901 Se\n0.333331 0.666693 0.230890 Se\n0.333344 0.666681 0.610058 Se\n0.666694 0.333317 0.052582 S\n0.666672 0.333281 0.140495 S\n",
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"structure_string": "Rb2 Li1 In1 Cl6\n1.0\n0.000000 5.069059 5.069059\n5.069059 0.000000 5.069059\n5.069059 5.069059 0.000000\nRb Li In Cl\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 In\n0.250192 0.749808 0.749808 Cl\n0.250192 0.749808 0.250192 Cl\n0.749808 0.250192 0.749808 Cl\n0.749808 0.749808 0.250192 Cl\n0.250192 0.250192 0.749808 Cl\n0.749808 0.250192 0.250192 Cl\n",
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{
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