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"structure_string": "Te4 W3 Se2\n1.0\n3.484344 0.000000 0.000000\n-1.742172 3.017652 0.000000\n0.000000 0.000000 21.592010\nTe W Se\n4 3 2\ndirect\n0.666742 0.333484 -0.056116 Te\n0.666713 0.333427 0.578558 Te\n0.666713 0.333427 0.115407 Te\n0.666742 0.333484 0.750080 Te\n0.333402 0.666803 0.029638 W\n0.333402 0.666803 0.664327 W\n0.666519 0.333039 0.346982 W\n0.333183 0.666365 0.422445 Se\n0.333183 0.666365 0.271520 Se\n",
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"structure_string": "H8 C6 O4\n1.0\n4.935872 0.052383 0.172686\n0.401289 4.420484 1.821953\n0.023416 -0.154886 6.684113\nH C O\n8 6 4\ndirect\n0.958062 0.269293 0.266393 H\n0.528170 0.951294 0.234492 H\n0.286984 0.094128 0.022937 H\n0.201406 0.108150 0.477849 H\n0.701406 0.601548 0.490944 H\n0.786954 0.132961 0.945870 H\n0.028155 0.201488 0.734333 H\n0.458050 0.551389 0.702385 H\n0.676346 0.530741 0.665920 C\n0.818746 0.738517 0.740572 C\n0.810496 0.214158 0.771294 C\n0.310513 0.000901 0.197516 C\n0.318755 0.494569 0.228231 C\n0.176356 0.212195 0.302871 C\n0.539534 0.518257 0.136755 O\n0.181025 0.721035 0.278207 O\n0.681002 0.014923 0.690610 O\n0.039533 0.670782 0.832044 O\n",
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"structure_string": "Te4 W3 Se2\n1.0\n3.484505 0.000004 0.000019\n-1.742249 3.017637 -0.000027\n0.000175 -0.000171 30.379423\nTe W Se\n4 3 2\ndirect\n0.333322 0.666651 0.403670 Te\n0.666644 0.333341 0.519727 Te\n0.666636 0.333347 0.641570 Te\n0.333328 0.666641 0.281772 Te\n0.333344 0.666634 0.117532 W\n0.333312 0.666686 0.580707 W\n0.666653 0.333305 0.342715 W\n0.666675 0.333286 0.063977 Se\n0.666674 0.333310 0.171170 Se\n",
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"structure_string": "W3 Se2 S4\n1.0\n3.235786 0.000000 -0.000000\n-1.617892 2.802251 -0.000000\n0.000000 -0.000000 27.942260\nW Se S\n3 2 4\ndirect\n0.333339 0.666677 0.115678 W\n0.333339 0.666677 0.578287 W\n0.666640 0.333278 0.346982 W\n0.333308 0.666615 0.408428 Se\n0.333308 0.666615 0.285537 Se\n0.666674 0.333344 0.059868 S\n0.666663 0.333324 0.522417 S\n0.666663 0.333324 0.171548 S\n0.666674 0.333344 0.634096 S\n",
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"structure_string": "Pr2 Ni3 P4\n1.0\n3.988517 0.000000 0.000000\n0.000000 3.988517 0.000000\n0.000000 0.000000 9.346150\nPr Ni P\n2 3 4\ndirect\n0.500000 0.000000 0.762531 Pr\n-0.000000 0.500000 0.237469 Pr\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Ni\n-0.000000 0.500000 0.879123 P\n0.500000 0.000000 0.377615 P\n0.500000 0.000000 0.120877 P\n-0.000000 0.500000 0.622385 P\n",
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