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{
"id": "mp-759884",
"created_at": "2022-09-04T14:43:52.651442Z",
"structure_string": "Li2 Mn2 V2 P4 H4 O20\n1.0\n-6.791253 0.000000 0.000000\n3.335121 6.565016 0.000000\n-0.169413 -0.653409 -8.103651\nLi Mn V P H O\n2 2 2 4 4 20\ndirect\n0.244080 0.149362 0.314183 Li\n0.755920 0.850638 0.685817 Li\n0.000000 0.000000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.500000 0.500000 0.000000 V\n0.000000 0.500000 0.500000 V\n0.713562 0.229877 0.160951 P\n0.787523 0.772115 0.339355 P\n0.212477 0.227885 0.660645 P\n0.286438 0.770123 0.839049 P\n0.134980 0.346662 0.147876 H\n0.648015 0.336029 0.660797 H\n0.351985 0.663971 0.339203 H\n0.865020 0.653338 0.852124 H\n0.661422 0.354185 0.035256 O\n0.988840 0.885048 0.235274 O\n0.514053 0.128838 0.269793 O\n0.765383 0.068949 0.062845 O\n0.266414 0.071808 0.551760 O\n0.924925 0.379786 0.265187 O\n0.833558 0.653724 0.472750 O\n0.422619 0.374249 0.765649 O\n0.227562 0.282039 0.100131 O\n0.728601 0.281801 0.584224 O\n0.271399 0.718199 0.415776 O\n0.772438 0.717961 0.899869 O\n0.577381 0.625751 0.234351 O\n0.166442 0.346276 0.527250 O\n0.075075 0.620214 0.734813 O\n0.733586 0.928192 0.448240 O\n0.234617 0.931051 0.937155 O\n0.485947 0.871162 0.730207 O\n0.011160 0.114952 0.764726 O\n0.338578 0.645815 0.964744 O\n",
"nsites": 34,
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"elements": [
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"density": 3.095681794370782,
"density_atomic": 0.09410495455131956,
"volume": 361.2987239843818,
"volume_molar": 6.399387565418634,
"formula_full": "Li2 Mn2 V2 P4 H4 O20",
"formula_reduced": "LiMnVP2(HO5)2",
"formula_anonymous": "ABCD2E2F10",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:25.202000Z",
"spacegroup": 2
},
{
"id": "mp-776591",
"created_at": "2022-09-04T14:41:08.435536Z",
"structure_string": "Li6 Mn3 V3 P6 H6 O30\n1.0\n5.488617 0.000000 0.000000\n-2.547012 6.981971 0.000000\n-0.371794 -1.504200 14.265790\nLi Mn V P H O\n6 3 3 6 6 30\ndirect\n0.256048 0.861944 0.695257 Li\n0.068225 0.465956 0.640715 Li\n0.407819 0.796846 0.974983 Li\n0.593851 0.202624 0.025904 Li\n0.932701 0.538317 0.357767 Li\n0.743236 0.132748 0.305797 Li\n0.335808 0.335428 0.835490 Mn\n0.666757 0.667543 0.667204 Mn\n0.668324 0.667265 0.166145 Mn\n0.334019 0.334194 0.331994 V\n0.994337 0.996795 0.499125 V\n0.001454 0.999051 0.000010 V\n0.013761 0.379104 0.145640 P\n0.320042 0.953629 0.186963 P\n0.348497 0.714940 0.480907 P\n0.640511 0.284691 0.518465 P\n0.681918 0.047810 0.812881 P\n0.992370 0.618723 0.854624 P\n0.052504 0.987548 0.325229 H\n0.278018 0.347635 0.007401 H\n0.390411 0.324811 0.661310 H\n0.616690 0.682550 0.338562 H\n0.722395 0.651754 0.992336 H\n0.943037 0.009134 0.675981 H\n0.093129 0.830530 0.902271 O\n0.059698 0.841219 0.225066 O\n0.137659 0.796243 0.447687 O\n0.211587 0.542771 0.885839 O\n0.297810 0.958389 0.078313 O\n0.036055 0.373437 0.254404 O\n0.351138 0.708349 0.587882 O\n0.249794 0.506036 0.430901 O\n0.054609 0.096966 0.371834 O\n0.274408 0.491689 0.107847 O\n0.280584 0.238223 0.961298 O\n0.576745 0.835540 0.766048 O\n0.541370 0.878278 0.214371 O\n0.388818 0.434348 0.706552 O\n0.619562 0.826432 0.447342 O\n0.371246 0.172760 0.552241 O\n0.617644 0.573460 0.292972 O\n0.461079 0.125247 0.786831 O\n0.423117 0.165502 0.233289 O\n0.721296 0.761005 0.039060 O\n0.729663 0.507918 0.892343 O\n0.942807 0.898834 0.629698 O\n0.744266 0.494632 0.567070 O\n0.629776 0.291785 0.409782 O\n0.979621 0.623028 0.747242 O\n0.705811 0.043167 0.921634 O\n0.792420 0.454500 0.118885 O\n0.852041 0.201627 0.547496 O\n0.942372 0.159415 0.774335 O\n0.911140 0.167628 0.098779 O\n",
"nsites": 54,
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"elements": [
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"Mn",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-Mn-O-P-V",
"density": 3.132110198347163,
"density_atomic": 0.09877725796907867,
"volume": 546.6845416675184,
"volume_molar": 6.09668752081089,
"formula_full": "Li6 Mn3 V3 P6 H6 O30",
"formula_reduced": "Li2MnVP2(HO5)2",
"formula_anonymous": "ABC2D2E2F10",
"energy": -396.84982422,
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"energy_uncorrected": -366.13582422,
"band_gap": 0.2444999999999999,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:08.300000Z",
"spacegroup": 1
},
{
"id": "mp-760245",
"created_at": "2022-09-04T14:42:16.157616Z",
"structure_string": "Li3 Mn3 V3 P6 H6 O30\n1.0\n7.351910 0.000000 0.000000\n-0.668738 8.090821 0.000000\n-2.343548 -3.868573 9.044094\nLi Mn V P H O\n3 3 3 6 6 30\ndirect\n0.010707 0.765952 0.162596 Li\n0.656276 0.569134 0.504443 Li\n0.988332 0.233802 0.837046 Li\n0.334832 0.668149 0.333588 Mn\n0.660077 0.332567 0.665694 Mn\n0.001914 0.001688 0.000851 Mn\n0.172569 0.833856 0.665705 V\n0.831719 0.165633 0.332907 V\n0.498843 0.499387 0.999729 V\n0.757990 0.923576 0.525087 P\n0.912745 0.410307 0.140807 P\n0.421634 0.257596 0.192874 P\n0.582783 0.744425 0.807592 P\n0.085912 0.590487 0.859337 P\n0.243268 0.076665 0.473750 P\n0.744527 0.897589 0.089744 H\n0.573206 0.777168 0.237496 H\n0.094830 0.555542 0.428732 H\n0.918738 0.435913 0.577765 H\n0.423675 0.222898 0.762537 H\n0.256450 0.102345 0.909534 H\n0.208816 0.900110 0.341508 O\n0.869857 0.976009 0.149652 O\n0.103536 0.536753 0.176339 O\n0.463939 0.675059 0.183620 O\n0.762313 0.951998 0.380288 O\n0.762195 0.528838 0.109031 O\n0.433303 0.289451 0.049557 O\n0.203719 0.657635 0.482553 O\n0.565055 0.802731 0.493398 O\n0.226298 0.143746 0.158643 O\n0.456164 0.433760 0.325423 O\n0.889559 0.238812 0.006029 O\n0.423581 0.854707 0.775209 O\n0.906333 0.803980 0.557887 O\n0.095659 0.625362 0.718686 O\n0.903698 0.376586 0.281976 O\n0.085767 0.188249 0.440586 O\n0.578708 0.145671 0.226232 O\n0.109331 0.761692 0.994384 O\n0.559442 0.573728 0.671913 O\n0.776188 0.863747 0.845328 O\n0.438843 0.189122 0.506878 O\n0.793446 0.357245 0.517012 O\n0.567493 0.707130 0.947438 O\n0.236346 0.471763 0.890974 O\n0.232418 0.045136 0.617262 O\n0.532945 0.324497 0.815640 O\n0.895166 0.462795 0.822277 O\n0.130896 0.023850 0.850043 O\n0.792851 0.101311 0.655847 O\n",
"nsites": 51,
"nelements": 6,
"elements": [
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"Mn",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-Mn-O-P-V",
"density": 3.1185747443178657,
"density_atomic": 0.09480087233532226,
"volume": 537.9697332278417,
"volume_molar": 6.352410702191594,
"formula_full": "Li3 Mn3 V3 P6 H6 O30",
"formula_reduced": "LiMnVP2(HO5)2",
"formula_anonymous": "ABCD2E2F10",
"energy": -380.57080273,
"energy_per_atom": -7.46217260254902,
"energy_above_hull": null,
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"energy_uncorrected": -349.85680273,
"band_gap": 0.7376999999999998,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:47.761000Z",
"spacegroup": 1
},
{
"id": "mp-849445",
"created_at": "2022-09-04T14:47:42.111944Z",
"structure_string": "Li4 Mn2 V2 P4 H4 O20\n1.0\n4.701993 -1.913425 4.635775\n-1.962391 7.049688 -0.043143\n-6.250202 -2.101261 4.806152\nLi Mn V P H O\n4 2 2 4 4 20\ndirect\n0.573511 0.826754 0.177127 Li\n0.070502 0.826106 0.676920 Li\n0.426426 0.173275 0.822789 Li\n0.929366 0.173989 0.323052 Li\n0.499918 0.999713 0.500083 Mn\n0.999967 0.000026 0.999907 Mn\n0.999867 0.500046 0.000050 V\n0.500046 0.499920 0.500107 V\n0.520557 0.231507 0.154445 P\n0.017108 0.231511 0.654369 P\n0.479428 0.768524 0.845581 P\n0.982928 0.768550 0.345643 P\n0.213184 0.335173 0.149902 H\n0.712553 0.339226 0.650359 H\n0.786927 0.665223 0.850195 H\n0.287378 0.660500 0.349592 H\n0.442632 0.725203 0.398427 O\n0.943331 0.729902 0.895551 O\n0.557301 0.274361 0.601467 O\n0.056743 0.270363 0.104506 O\n0.461767 0.378081 0.260657 O\n0.958031 0.378363 0.760378 O\n0.538301 0.621925 0.739355 O\n0.041877 0.621659 0.239531 O\n0.327093 0.652242 0.980902 O\n0.833652 0.657065 0.482255 O\n0.672882 0.347844 0.019105 O\n0.166399 0.342938 0.517760 O\n0.308445 0.067982 0.052701 O\n0.802532 0.065132 0.555523 O\n0.691608 0.932084 0.947227 O\n0.197648 0.934671 0.444477 O\n0.619288 0.120986 0.261404 O\n0.117154 0.122273 0.761631 O\n0.380698 0.878978 0.738601 O\n0.882954 0.877902 0.238424 O\n",
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"elements": [
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"formula_full": "Li4 Mn2 V2 P4 H4 O20",
"formula_reduced": "Li2MnVP2(HO5)2",
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"energy": -265.3828897,
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"spacegroup": 2
},
{
"id": "mp-849423",
"created_at": "2022-09-04T14:45:18.591974Z",
"structure_string": "Li6 Mn3 V3 P6 H6 O30\n1.0\n5.460984 0.000000 0.000000\n-2.658195 6.953998 0.000000\n-0.314774 -1.643651 14.460060\nLi Mn V P H O\n6 3 3 6 6 30\ndirect\n0.261638 0.865308 0.693767 Li\n0.067600 0.466780 0.641690 Li\n0.404095 0.796963 0.974079 Li\n0.601055 0.203476 0.024834 Li\n0.931527 0.532679 0.359394 Li\n0.735184 0.133429 0.306887 Li\n0.335511 0.335410 0.834783 Mn\n0.333172 0.333643 0.333378 Mn\n0.668108 0.667989 0.666369 Mn\n0.662393 0.663872 0.165850 V\n0.999909 0.000073 0.500150 V\n0.000601 0.999090 0.999215 V\n0.013518 0.379997 0.148538 P\n0.311291 0.951779 0.184408 P\n0.349363 0.715660 0.481840 P\n0.651049 0.284967 0.517981 P\n0.683393 0.047549 0.814134 P\n0.988613 0.619174 0.852580 P\n0.052894 0.989748 0.326632 H\n0.284656 0.347029 0.007946 H\n0.388273 0.325418 0.658687 H\n0.615034 0.677060 0.341030 H\n0.715175 0.652559 0.991778 H\n0.946406 0.010313 0.674506 H\n0.090749 0.830371 0.901104 O\n0.039048 0.837759 0.218548 O\n0.141079 0.798436 0.448661 O\n0.204641 0.540732 0.884585 O\n0.296479 0.955815 0.077338 O\n0.020185 0.375369 0.254214 O\n0.355595 0.712741 0.587526 O\n0.248038 0.504903 0.432629 O\n0.050931 0.100489 0.370264 O\n0.287770 0.494471 0.115074 O\n0.285756 0.237866 0.962917 O\n0.577552 0.836194 0.765860 O\n0.522428 0.869485 0.213978 O\n0.388019 0.435372 0.703447 O\n0.624956 0.828583 0.448379 O\n0.375483 0.171368 0.551113 O\n0.615100 0.566486 0.296775 O\n0.464991 0.126592 0.787286 O\n0.416253 0.162450 0.232876 O\n0.719514 0.762073 0.037780 O\n0.720604 0.507378 0.889014 O\n0.948589 0.899979 0.630095 O\n0.752196 0.495603 0.567044 O\n0.644925 0.288374 0.412070 O\n0.977908 0.623256 0.746885 O\n0.704813 0.042371 0.921300 O\n0.803744 0.461654 0.115917 O\n0.858983 0.201935 0.550973 O\n0.949379 0.161043 0.777354 O\n0.913839 0.170887 0.098544 O\n",
"nsites": 54,
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"elements": [
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"density": 3.118159071755183,
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"volume_molar": 6.1239650449644945,
"formula_full": "Li6 Mn3 V3 P6 H6 O30",
"formula_reduced": "Li2MnVP2(HO5)2",
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"energy": -397.47439363,
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"updated_at": "2021-11-28T01:37:00.769000Z",
"spacegroup": 1
},
{
"id": "mp-849682",
"created_at": "2022-09-04T14:47:32.939011Z",
"structure_string": "Li6 Mn3 V3 P6 H6 O30\n1.0\n5.435882 0.000000 0.000000\n1.891777 9.999378 0.000000\n1.233157 1.715531 10.100622\nLi Mn V P H O\n6 3 3 6 6 30\ndirect\n0.207697 0.191540 0.365662 Li\n0.125465 0.475416 0.300946 Li\n0.458370 0.143611 0.966174 Li\n0.542427 0.855924 0.034198 Li\n0.875935 0.524903 0.698639 Li\n0.790521 0.808855 0.633703 Li\n0.168036 0.832356 0.332559 Mn\n0.333563 0.666432 0.667674 Mn\n0.667105 0.333486 0.333090 Mn\n0.500259 0.499965 0.000334 V\n0.829805 0.168318 0.666141 V\n0.999215 0.000178 0.000301 V\n0.060805 0.303754 0.070819 P\n0.271173 0.363244 0.595422 P\n0.605460 0.028823 0.262675 P\n0.391053 0.970531 0.738069 P\n0.731423 0.637903 0.404241 P\n0.938790 0.696118 0.928977 P\n0.174149 0.766207 0.105425 H\n0.163838 0.897119 0.563256 H\n0.496968 0.564480 0.230269 H\n0.503034 0.435990 0.770557 H\n0.836488 0.102208 0.436357 H\n0.825856 0.233320 0.894379 H\n0.108336 0.148438 0.074640 O\n0.014167 0.336365 0.213614 O\n0.023070 0.318839 0.665298 O\n0.166863 0.036293 0.654815 O\n0.164405 0.630303 0.011379 O\n0.310302 0.347935 0.000915 O\n0.195576 0.854216 0.127247 O\n0.336592 0.003906 0.881901 O\n0.320053 0.329370 0.452982 O\n0.224622 0.518792 0.591125 O\n0.142264 0.808443 0.542323 O\n0.551471 0.184530 0.257175 O\n0.473788 0.476640 0.207502 O\n0.497034 0.297872 0.678107 O\n0.350198 0.984089 0.327268 O\n0.640064 0.015131 0.670533 O\n0.512063 0.700339 0.318980 O\n0.526816 0.523706 0.792587 O\n0.441026 0.814845 0.744048 O\n0.860204 0.190152 0.458475 O\n0.783453 0.481842 0.408753 O\n0.681951 0.671105 0.546207 O\n0.662682 0.996100 0.118787 O\n0.805839 0.145901 0.871361 O\n0.689268 0.652090 0.999306 O\n0.835185 0.369641 0.988779 O\n0.823468 0.965750 0.348223 O\n0.986194 0.681824 0.336128 O\n0.984573 0.663198 0.786763 O\n0.891041 0.851666 0.924916 O\n",
"nsites": 54,
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"elements": [
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"O"
],
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"density": 3.1187653609811505,
"density_atomic": 0.0983564022649104,
"volume": 549.0237417850839,
"volume_molar": 6.122774543725313,
"formula_full": "Li6 Mn3 V3 P6 H6 O30",
"formula_reduced": "Li2MnVP2(HO5)2",
"formula_anonymous": "ABC2D2E2F10",
"energy": -397.24084626,
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"spacegroup": 1
},
{
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{
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{
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"structure_string": "Li4 Mn2 V2 P4 H4 O20\n1.0\n6.955908 0.000000 0.000000\n-0.102287 7.495717 0.000000\n-0.216182 -3.553798 7.010271\nLi Mn V P H O\n4 2 2 4 4 20\ndirect\n0.161349 0.584701 0.762741 Li\n0.340583 0.914079 0.739938 Li\n0.658739 0.088871 0.261255 Li\n0.838227 0.413136 0.235132 Li\n0.251165 0.749673 0.249449 Mn\n0.501728 0.499971 0.500979 Mn\n0.999175 0.999997 0.000819 V\n0.748497 0.251270 0.750746 V\n0.590800 0.726625 0.961321 P\n0.097481 0.227380 0.458758 P\n0.907133 0.775459 0.540693 P\n0.404966 0.271443 0.039836 P\n0.042678 0.320563 0.980768 H\n0.545241 0.813277 0.483299 H\n0.455942 0.184822 0.517438 H\n0.956074 0.679275 0.017375 H\n0.054328 0.837519 0.712555 O\n0.012426 0.692837 0.347660 O\n0.439741 0.669757 0.796159 O\n0.717540 0.906815 0.981363 O\n0.076216 0.756317 0.026538 O\n0.221198 0.409139 0.477129 O\n0.424687 0.736461 0.474890 O\n0.720935 0.549416 0.931546 O\n0.504047 0.188324 0.843219 O\n0.776088 0.950811 0.567897 O\n0.227481 0.053047 0.434138 O\n0.491200 0.810131 0.158634 O\n0.275589 0.447488 0.067241 O\n0.577857 0.261424 0.527918 O\n0.782419 0.592757 0.518805 O\n0.921280 0.243178 0.968529 O\n0.278690 0.091854 0.022631 O\n0.558090 0.329185 0.204674 O\n0.992530 0.309284 0.650965 O\n0.947880 0.163714 0.286964 O\n",
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{
"id": "mp-754810",
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"structure_string": "Li2 Mn1 V1 P2 H2 O10\n1.0\n5.501967 -0.048545 -0.133190\n-2.159870 7.007774 0.124176\n-0.765502 -1.863735 4.752667\nLi Mn V P H O\n2 1 1 2 2 10\ndirect\n0.388208 0.825304 0.743389 Li\n0.611941 0.174716 0.256564 Li\n0.999986 0.500172 0.000438 Mn\n0.000005 0.999949 0.000029 V\n0.367056 0.233994 0.672323 P\n0.632697 0.765942 0.327614 P\n0.074581 0.345320 0.357796 H\n0.925604 0.654704 0.642154 H\n0.041300 0.719888 0.841032 O\n0.222428 0.383888 0.710430 O\n0.333379 0.662828 0.304707 O\n0.258587 0.072375 0.367138 O\n0.337925 0.115716 0.881742 O\n0.662164 0.884223 0.118349 O\n0.741549 0.927604 0.632655 O\n0.666339 0.337045 0.694953 O\n0.777621 0.616271 0.289648 O\n0.958628 0.280060 0.159040 O\n",
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{
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"structure_string": "Li4 Mn2 V2 P4 H4 O20\n1.0\n6.929624 0.000000 0.000000\n-3.293548 6.522161 0.000000\n-0.479628 -0.388309 8.067662\nLi Mn V P H O\n4 2 2 4 4 20\ndirect\n0.074497 0.822857 0.676884 Li\n0.428817 0.173536 0.825271 Li\n0.571183 0.826464 0.174729 Li\n0.925503 0.177143 0.323116 Li\n0.000000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 V\n0.500000 0.500000 0.500000 V\n0.482925 0.766609 0.843938 P\n0.018588 0.231173 0.655282 P\n0.981412 0.768827 0.344718 P\n0.517075 0.233391 0.156062 P\n0.790134 0.654916 0.853500 H\n0.287851 0.667410 0.351407 H\n0.712149 0.332590 0.648593 H\n0.209866 0.345084 0.146500 H\n0.337296 0.655516 0.984329 O\n0.111278 0.118184 0.774408 O\n0.383396 0.879697 0.736091 O\n0.695869 0.930032 0.938014 O\n0.184955 0.931004 0.447981 O\n0.539283 0.620542 0.737843 O\n0.180643 0.341883 0.522425 O\n0.038430 0.619074 0.248283 O\n0.945023 0.719942 0.896799 O\n0.443059 0.731509 0.395919 O\n0.556941 0.268491 0.604081 O\n0.054977 0.280058 0.103201 O\n0.961570 0.380926 0.751717 O\n0.819357 0.658117 0.477575 O\n0.460717 0.379458 0.262157 O\n0.815045 0.068996 0.552019 O\n0.304131 0.069968 0.061986 O\n0.616604 0.120303 0.263909 O\n0.888722 0.881816 0.225592 O\n0.662704 0.344484 0.015671 O\n",
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{
"id": "mp-1177933",
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"structure_string": "Li6 Mn3 V3 P6 H6 O30\n1.0\n5.418058 0.000000 0.000000\n-1.960781 7.103578 0.000000\n-1.126826 -1.036258 14.219948\nLi Mn V P H O\n6 3 3 6 6 30\ndirect\n0.849189 0.422696 0.249487 Li\n0.815859 0.243357 0.416959 Li\n0.519928 0.093543 0.915216 Li\n0.482110 0.906211 0.084678 Li\n0.183218 0.756680 0.582883 Li\n0.150346 0.577285 0.750694 Li\n0.666412 0.166560 0.666745 Mn\n0.667108 0.666676 0.666347 Mn\n0.332584 0.332886 0.334062 Mn\n0.999988 0.500174 0.000034 V\n0.000972 0.000676 0.999523 V\n0.333648 0.833413 0.333269 V\n0.807324 0.672016 0.440484 P\n0.859662 0.994322 0.225746 P\n0.468566 0.337958 0.107917 P\n0.531199 0.662751 0.892321 P\n0.142428 0.008762 0.772543 P\n0.190667 0.324212 0.561019 P\n0.936697 0.217730 0.878111 H\n0.724925 0.456779 0.786388 H\n0.390681 0.117286 0.452921 H\n0.608306 0.876315 0.546709 H\n0.277025 0.549579 0.214464 H\n0.062509 0.782588 0.121315 H\n0.864687 0.051624 0.123352 O\n0.940117 0.172287 0.295163 O\n0.965650 0.141707 0.758047 O\n0.899628 0.217469 0.566231 O\n0.898589 0.220585 0.944814 O\n0.755846 0.441801 0.100578 O\n0.725931 0.494372 0.370937 O\n0.801345 0.613293 0.543091 O\n0.773422 0.458664 0.720788 O\n0.377527 0.158709 0.037496 O\n0.464179 0.277659 0.210308 O\n0.437023 0.117483 0.386935 O\n0.703682 0.528440 0.908440 O\n0.629151 0.803758 0.423823 O\n0.433379 0.116491 0.767471 O\n0.572556 0.883987 0.231412 O\n0.366875 0.190919 0.575038 O\n0.295634 0.472188 0.092413 O\n0.560108 0.874434 0.612245 O\n0.535070 0.722780 0.789974 O\n0.623044 0.842359 0.962490 O\n0.229485 0.548978 0.280336 O\n0.194338 0.381890 0.457837 O\n0.273395 0.501100 0.630408 O\n0.244125 0.558728 0.899925 O\n0.102180 0.780081 0.054866 O\n0.094118 0.782282 0.434726 O\n0.038126 0.862550 0.242535 O\n0.060603 0.831560 0.703252 O\n0.138833 0.951367 0.875235 O\n",
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"formula_full": "Li6 Mn3 V3 P6 H6 O30",
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}
]
}