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{
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"results": [
{
"id": "mp-1399321",
"created_at": "2022-09-04T14:43:21.928026Z",
"structure_string": "Cs1 Ag1 Br3\n1.0\n5.497825 0.000000 0.000000\n0.000000 5.494482 0.000000\n0.000000 0.005156 5.494830\nCs Ag Br\n1 1 3\ndirect\n0.000000 0.998536 0.005989 Cs\n0.500000 0.504661 0.515264 Ag\n0.000000 0.505285 0.513036 Br\n0.500000 0.497025 0.015150 Br\n0.500000 0.004494 0.510564 Br\n",
"nsites": 5,
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"elements": [
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"Ag",
"Br"
],
"chemical_system": "Ag-Br-Cs",
"density": 4.806817055371613,
"density_atomic": 0.03012298994834995,
"volume": 165.98617894748145,
"volume_molar": 19.991842676725636,
"formula_full": "Cs1 Ag1 Br3",
"formula_reduced": "CsAgBr3",
"formula_anonymous": "ABC3",
"energy": -14.847084000000002,
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"updated_at": "2021-11-28T01:36:08.221000Z",
"spacegroup": 38
},
{
"id": "mp-571100",
"created_at": "2022-09-04T14:46:26.626789Z",
"structure_string": "Cs2 Ag2 Br4\n1.0\n5.369928 0.000000 0.000000\n0.000000 5.369928 0.000000\n0.000000 0.000000 10.430716\nCs Ag Br\n2 2 4\ndirect\n0.500000 0.000000 0.706757 Cs\n0.000000 0.500000 0.293243 Cs\n0.500000 0.000000 0.099960 Ag\n0.000000 0.500000 0.900040 Ag\n0.000000 0.000000 0.000000 Br\n0.500000 0.000000 0.355076 Br\n0.000000 0.500000 0.644924 Br\n0.500000 0.500000 0.000000 Br\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cs",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Cs",
"density": 4.423022003906959,
"density_atomic": 0.026597385052432882,
"volume": 300.7814484104043,
"volume_molar": 22.641852754051662,
"formula_full": "Cs2 Ag2 Br4",
"formula_reduced": "CsAgBr2",
"formula_anonymous": "ABC2",
"energy": -24.86163218,
"energy_per_atom": -3.1077040225,
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"band_gap": 1.7972,
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"updated_at": "2021-11-28T01:37:35.654000Z",
"spacegroup": 129
},
{
"id": "mp-640052",
"created_at": "2022-09-04T14:48:03.650589Z",
"structure_string": "Cs8 Ag4 Br12\n1.0\n4.820438 0.000000 0.000000\n0.000000 14.089742 0.000000\n0.000000 0.000000 14.656885\nCs Ag Br\n8 4 12\ndirect\n0.750000 0.988574 0.825945 Cs\n0.250000 0.172446 0.519065 Cs\n0.750000 0.827554 0.480935 Cs\n0.750000 0.488574 0.674055 Cs\n0.250000 0.511426 0.325945 Cs\n0.250000 0.011426 0.174055 Cs\n0.750000 0.327554 0.019065 Cs\n0.250000 0.672446 0.980935 Cs\n0.250000 0.255158 0.804238 Ag\n0.750000 0.244842 0.304238 Ag\n0.250000 0.755158 0.695762 Ag\n0.750000 0.744842 0.195762 Ag\n0.250000 0.137855 0.950874 Br\n0.750000 0.224832 0.712068 Br\n0.750000 0.862145 0.049126 Br\n0.250000 0.440306 0.859668 Br\n0.250000 0.775168 0.287932 Br\n0.750000 0.724832 0.787932 Br\n0.250000 0.275168 0.212068 Br\n0.250000 0.637855 0.549126 Br\n0.750000 0.059694 0.359668 Br\n0.750000 0.559694 0.140332 Br\n0.750000 0.362145 0.450874 Br\n0.250000 0.940306 0.640332 Br\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Cs",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Cs",
"density": 4.092751151255834,
"density_atomic": 0.024109045649023844,
"volume": 995.4769819340295,
"volume_molar": 24.978760452277925,
"formula_full": "Cs8 Ag4 Br12",
"formula_reduced": "Cs2AgBr3",
"formula_anonymous": "AB2C3",
"energy": -76.65234721,
"energy_per_atom": -3.1938478004166666,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -70.24434721,
"band_gap": 2.7333,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 0.0043441,
"is_theoretical": false,
"updated_at": "2021-11-28T01:38:22.362000Z",
"spacegroup": 62
},
{
"id": "mp-23454",
"created_at": "2022-09-04T14:39:11.293390Z",
"structure_string": "Cs2 Ag2 Br4\n1.0\n2.333062 -10.172286 0.000000\n2.333062 10.172286 0.000000\n0.000000 0.000000 6.044446\nCs Ag Br\n2 2 4\ndirect\n0.584566 0.415434 0.750000 Cs\n0.415434 0.584566 0.250000 Cs\n0.200898 0.799102 0.250000 Ag\n0.799102 0.200898 0.750000 Ag\n0.930699 0.069301 0.750000 Br\n0.069301 0.930699 0.250000 Br\n0.774695 0.225305 0.250000 Br\n0.225305 0.774695 0.750000 Br\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cs",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Cs",
"density": 4.6370182625881435,
"density_atomic": 0.027884229406111398,
"volume": 286.90052299765676,
"volume_molar": 21.59694167011883,
"formula_full": "Cs2 Ag2 Br4",
"formula_reduced": "CsAgBr2",
"formula_anonymous": "ABC2",
"energy": -24.79207658,
"energy_per_atom": -3.0990095725,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -22.65607658,
"band_gap": 2.0566,
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"is_magnetic": false,
"total_magnetization": 0.0020387,
"is_theoretical": false,
"updated_at": "2021-11-28T01:34:30.077000Z",
"spacegroup": 63
},
{
"id": "mp-998344",
"created_at": "2022-09-04T14:41:23.013581Z",
"structure_string": "Cs1 Ag1 Br3\n1.0\n-0.003471 -5.494831 -0.002843\n-5.497825 -0.001625 -0.001137\n-0.001353 -0.002313 -5.494481\nCs Ag Br\n1 1 3\ndirect\n0.994011 0.000431 0.001464 Cs\n0.484736 0.499160 0.495339 Ag\n0.486964 0.999292 0.494715 Br\n0.984850 0.502902 0.502975 Br\n0.489436 0.498215 0.995506 Br\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Cs",
"Ag",
"Br"
],
"chemical_system": "Ag-Br-Cs",
"density": 4.806819244203732,
"density_atomic": 0.030123003665154056,
"volume": 165.98610336405272,
"volume_molar": 19.9918335732447,
"formula_full": "Cs1 Ag1 Br3",
"formula_reduced": "CsAgBr3",
"formula_anonymous": "ABC3",
"energy": -14.846985030000004,
"energy_per_atom": -2.969397006000001,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
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"energy_uncorrected": -13.24498503,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0008237,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:18.482000Z",
"spacegroup": 6
},
{
"id": "mp-1214977",
"created_at": "2022-09-04T14:39:24.568867Z",
"structure_string": "Ag4 C16 Br8 O8\n1.0\n5.817869 0.000000 0.000000\n0.000000 9.827713 0.000000\n0.000000 6.794825 11.104688\nAg C Br O\n4 16 8 8\ndirect\n0.786770 0.578150 0.495994 Ag\n0.213230 0.421850 0.504006 Ag\n0.286770 0.421850 0.004006 Ag\n0.713230 0.578150 0.995994 Ag\n0.369911 0.877503 0.500706 C\n0.630089 0.122497 0.499294 C\n0.869911 0.122497 0.999294 C\n0.130089 0.877503 0.000706 C\n0.840662 0.962925 0.091935 C\n0.159338 0.037075 0.908065 C\n0.340662 0.037075 0.408065 C\n0.659338 0.962925 0.591935 C\n0.738344 0.255827 0.999784 C\n0.261656 0.744173 0.000216 C\n0.238344 0.744173 0.500216 C\n0.761656 0.255827 0.499784 C\n0.972416 0.842954 0.092825 C\n0.027584 0.157046 0.907175 C\n0.472416 0.157046 0.407175 C\n0.527584 0.842954 0.592825 C\n0.946675 0.628760 0.222714 Br\n0.053325 0.371240 0.777286 Br\n0.446675 0.371240 0.277286 Br\n0.553325 0.628760 0.722714 Br\n0.620580 0.910279 0.214592 Br\n0.379420 0.089721 0.785408 Br\n0.120580 0.089721 0.285408 Br\n0.879420 0.910279 0.714592 Br\n0.855201 0.345109 0.024594 O\n0.144799 0.654891 0.975406 O\n0.355201 0.654891 0.475406 O\n0.644799 0.345109 0.524594 O\n0.474198 0.734346 0.023425 O\n0.525802 0.265654 0.976575 O\n0.974198 0.265654 0.476575 O\n0.025802 0.734346 0.523425 O\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Ag",
"C",
"Br",
"O"
],
"chemical_system": "Ag-Br-C-O",
"density": 3.6375858151220144,
"density_atomic": 0.05669956623311471,
"volume": 634.9254922337418,
"volume_molar": 10.621140795399667,
"formula_full": "Ag4 C16 Br8 O8",
"formula_reduced": "AgC4(BrO)2",
"formula_anonymous": "AB2C2D4",
"energy": -228.63489184,
"energy_per_atom": -6.350969217777777,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -218.86689184,
"band_gap": 2.5782,
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"is_magnetic": false,
"total_magnetization": 0.0028276,
"is_theoretical": true,
"updated_at": "2021-11-28T01:34:23.386000Z",
"spacegroup": 14
},
{
"id": "mp-725087",
"created_at": "2022-09-04T14:42:13.145720Z",
"structure_string": "Ag8 C16 Br12 N4\n1.0\n7.111520 0.000000 0.000000\n0.000000 9.552456 0.000000\n0.000000 0.000000 14.840282\nAg C Br N\n8 16 12 4\ndirect\n0.493971 0.098633 0.595960 Ag\n0.006029 0.401367 0.095960 Ag\n0.993971 0.901367 0.404040 Ag\n0.506029 0.598633 0.904040 Ag\n0.506029 0.901367 0.404040 Ag\n0.993971 0.598633 0.904040 Ag\n0.006029 0.098633 0.595960 Ag\n0.493971 0.401367 0.095960 Ag\n0.250000 0.406356 0.679616 C\n0.250000 0.093644 0.179616 C\n0.750000 0.593644 0.320384 C\n0.750000 0.906356 0.820384 C\n0.250000 0.490390 0.600008 C\n0.250000 0.009610 0.100008 C\n0.750000 0.509610 0.399992 C\n0.750000 0.990390 0.899992 C\n0.137144 0.617814 0.626904 C\n0.362856 0.882186 0.126904 C\n0.637144 0.382186 0.373096 C\n0.862856 0.117814 0.873096 C\n0.862856 0.382186 0.373096 C\n0.637144 0.117814 0.873096 C\n0.362856 0.617814 0.626904 C\n0.137144 0.882186 0.126904 C\n0.250000 0.129034 0.454529 Br\n0.250000 0.370966 0.954529 Br\n0.750000 0.870966 0.545471 Br\n0.750000 0.629034 0.045471 Br\n0.750000 0.291670 0.598691 Br\n0.750000 0.208330 0.098691 Br\n0.250000 0.708330 0.401309 Br\n0.250000 0.791670 0.901309 Br\n0.250000 0.977621 0.698601 Br\n0.250000 0.522379 0.198601 Br\n0.750000 0.022379 0.301399 Br\n0.750000 0.477621 0.801399 Br\n0.250000 0.551290 0.706781 N\n0.250000 0.948710 0.206781 N\n0.750000 0.448710 0.293219 N\n0.750000 0.051290 0.793219 N\n",
"nsites": 40,
"nelements": 4,
"elements": [
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"C",
"Br",
"N"
],
"chemical_system": "Ag-Br-C-N",
"density": 3.409557706414568,
"density_atomic": 0.03967713964533382,
"volume": 1008.1371882537946,
"volume_molar": 15.177860132637425,
"formula_full": "Ag8 C16 Br12 N4",
"formula_reduced": "Ag2C4Br3N",
"formula_anonymous": "AB2C3D4",
"energy": -180.19560756,
"energy_per_atom": -4.504890189,
"energy_above_hull": null,
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"energy_uncorrected": -172.34360756,
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"is_theoretical": false,
"updated_at": "2021-11-28T01:35:37.233000Z",
"spacegroup": 62
},
{
"id": "mp-1229222",
"created_at": "2022-09-04T14:46:55.036644Z",
"structure_string": "Ag40 Te16 Br4 Cl4\n1.0\n7.744135 0.000000 0.000000\n0.000000 14.127610 0.000000\n0.000000 14.110549 14.181823\nAg Te Br Cl\n40 16 4 4\ndirect\n0.696335 0.151359 0.146412 Ag\n0.803665 0.151359 0.646412 Ag\n0.303665 0.848641 0.853588 Ag\n0.196335 0.848641 0.353588 Ag\n0.706388 0.946634 0.352106 Ag\n0.793612 0.946634 0.852106 Ag\n0.293612 0.053366 0.647894 Ag\n0.206388 0.053366 0.147894 Ag\n0.993178 0.253584 0.359097 Ag\n0.506822 0.253584 0.859097 Ag\n0.006822 0.746416 0.640903 Ag\n0.493178 0.746416 0.140903 Ag\n0.992298 0.465733 0.143642 Ag\n0.507702 0.465733 0.643642 Ag\n0.007702 0.534267 0.856358 Ag\n0.492298 0.534267 0.356358 Ag\n0.643915 0.370730 0.249811 Ag\n0.856085 0.370730 0.749811 Ag\n0.356085 0.629270 0.750189 Ag\n0.143915 0.629270 0.250189 Ag\n0.624040 0.522256 0.899928 Ag\n0.875960 0.522256 0.399928 Ag\n0.375960 0.477744 0.100072 Ag\n0.124040 0.477744 0.600072 Ag\n0.374227 0.175893 0.399107 Ag\n0.125773 0.175893 0.899107 Ag\n0.625773 0.824107 0.600893 Ag\n0.874227 0.824107 0.100893 Ag\n0.936522 0.177282 0.249596 Ag\n0.563478 0.177282 0.749596 Ag\n0.063478 0.822718 0.750404 Ag\n0.436522 0.822718 0.250404 Ag\n0.874332 0.009346 0.572470 Ag\n0.625668 0.009346 0.072470 Ag\n0.125668 0.990654 0.427530 Ag\n0.374332 0.990654 0.927530 Ag\n0.870975 0.652743 0.927026 Ag\n0.629025 0.652743 0.427026 Ag\n0.129025 0.347257 0.072974 Ag\n0.370975 0.347257 0.572974 Ag\n0.764306 0.561867 0.249650 Te\n0.735694 0.561867 0.749650 Te\n0.235694 0.438133 0.750350 Te\n0.264306 0.438133 0.250350 Te\n0.717191 0.080251 0.411512 Te\n0.782809 0.080251 0.911512 Te\n0.282809 0.919749 0.588488 Te\n0.217191 0.919749 0.088488 Te\n0.713766 0.402930 0.088330 Te\n0.786234 0.402930 0.588330 Te\n0.286234 0.597070 0.911670 Te\n0.213766 0.597070 0.411670 Te\n0.787705 0.885707 0.249984 Te\n0.712295 0.885707 0.749984 Te\n0.212295 0.114293 0.750016 Te\n0.287705 0.114293 0.250016 Te\n0.475128 0.754155 0.499186 Br\n0.024872 0.754155 0.999186 Br\n0.524872 0.245845 0.500814 Br\n0.975128 0.245845 0.000814 Br\n0.982126 0.752276 0.498108 Cl\n0.517874 0.752276 0.998108 Cl\n0.017874 0.247724 0.501892 Cl\n0.482126 0.247724 0.001892 Cl\n",
"nsites": 64,
"nelements": 4,
"elements": [
"Ag",
"Te",
"Br",
"Cl"
],
"chemical_system": "Ag-Br-Cl-Te",
"density": 7.29653849852453,
"density_atomic": 0.04124832338528632,
"volume": 1551.5782157300828,
"volume_molar": 14.59972252386907,
"formula_full": "Ag40 Te16 Br4 Cl4",
"formula_reduced": "Ag10Te4BrCl",
"formula_anonymous": "ABC4D10",
"energy": -199.11683788,
"energy_per_atom": -3.111200591875,
"energy_above_hull": null,
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"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -187.77283788,
"band_gap": 0.2208000000000001,
"is_gap_direct": true,
"is_magnetic": false,
"total_magnetization": 2.46e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:43.815000Z",
"spacegroup": 14
},
{
"id": "mp-1229155",
"created_at": "2022-09-04T14:44:59.923890Z",
"structure_string": "Ag4 Hg4 S4 Br1 Cl3\n1.0\n4.538843 0.000000 0.000000\n0.013562 6.980989 0.000000\n0.011766 0.062472 13.284895\nAg Hg S Br Cl\n4 4 4 1 3\ndirect\n0.012024 0.790099 0.457361 Ag\n0.011588 0.211102 0.544301 Ag\n0.987252 0.291745 0.043733 Ag\n0.987558 0.705153 0.949779 Ag\n0.501077 0.627531 0.244061 Hg\n0.504748 0.370571 0.757356 Hg\n0.495424 0.128734 0.262097 Hg\n0.496558 0.871745 0.739496 Hg\n0.509305 0.861151 0.378621 S\n0.509056 0.137599 0.623569 S\n0.489144 0.362789 0.127331 S\n0.491765 0.635538 0.872781 S\n0.004816 0.874179 0.127765 Br\n0.000060 0.133247 0.870030 Cl\n0.999898 0.371000 0.372063 Cl\n0.999726 0.627817 0.629655 Cl\n",
"nsites": 16,
"nelements": 5,
"elements": [
"Ag",
"Hg",
"S",
"Br",
"Cl"
],
"chemical_system": "Ag-Br-Cl-Hg-S",
"density": 6.10800835172548,
"density_atomic": 0.038010163886164086,
"volume": 420.9400424559624,
"volume_molar": 15.843501169938635,
"formula_full": "Ag4 Hg4 S4 Br1 Cl3",
"formula_reduced": "Ag4Hg4S4BrCl3",
"formula_anonymous": "AB3C4D4E4",
"energy": -45.89547896,
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"energy_uncorrected": -41.50747896,
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"updated_at": "2021-11-28T01:36:52.070000Z",
"spacegroup": 1
},
{
"id": "mp-1229204",
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},
{
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"spacegroup": 13
},
{
"id": "mp-1202066",
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"structure_string": "Ag8 H64 C16 S16 Br8 N32\n1.0\n6.215998 0.000000 0.000000\n0.000000 8.590120 0.000000\n-1.817837 0.000000 38.531734\nAg H C S Br N\n8 64 16 16 8 32\ndirect\n0.710080 0.809844 0.591705 Ag\n0.289920 0.309844 0.908295 Ag\n0.289920 0.190156 0.408295 Ag\n0.710080 0.690156 0.091705 Ag\n0.378524 0.748870 0.656662 Ag\n0.621476 0.248870 0.843338 Ag\n0.621476 0.251130 0.343338 Ag\n0.378524 0.751130 0.156662 Ag\n0.352846 0.990683 0.787161 H\n0.647154 0.490683 0.712839 H\n0.647154 0.009317 0.212839 H\n0.352846 0.509317 0.287161 H\n0.618389 0.988170 0.773759 H\n0.381611 0.488170 0.726241 H\n0.381611 0.011830 0.226241 H\n0.618389 0.511830 0.273759 H\n0.078275 0.896876 0.752843 H\n0.921725 0.396876 0.747157 H\n0.921725 0.103124 0.247157 H\n0.078275 0.603124 0.252843 H\n0.122650 0.821672 0.711413 H\n0.877350 0.321672 0.788587 H\n0.877350 0.178328 0.288587 H\n0.122650 0.678328 0.211413 H\n0.018693 0.461309 0.579716 H\n0.981307 0.961309 0.920284 H\n0.981307 0.538691 0.420284 H\n0.018693 0.038691 0.079716 H\n0.113256 0.494668 0.622720 H\n0.886744 0.994668 0.877280 H\n0.886744 0.505332 0.377280 H\n0.113256 0.005332 0.122720 H\n0.262909 0.460128 0.534725 H\n0.737091 0.960128 0.965275 H\n0.737091 0.539872 0.465275 H\n0.262909 0.039872 0.034725 H\n0.527489 0.524039 0.544625 H\n0.472511 0.024039 0.955375 H\n0.472511 0.475961 0.455375 H\n0.527489 0.975961 0.044625 H\n0.854190 0.273382 0.649715 H\n0.145810 0.773382 0.850285 H\n0.145810 0.726618 0.350285 H\n0.854190 0.226618 0.149715 H\n0.744937 0.126666 0.621869 H\n0.255063 0.626666 0.878131 H\n0.255063 0.873334 0.378131 H\n0.744937 0.373334 0.121869 H\n0.186395 0.249195 0.675065 H\n0.813605 0.749195 0.824935 H\n0.813605 0.750805 0.324935 H\n0.186395 0.250805 0.175065 H\n0.336190 0.074715 0.670742 H\n0.663810 0.574715 0.829258 H\n0.663810 0.925285 0.329258 H\n0.336190 0.425285 0.170742 H\n0.767685 0.231117 0.493316 H\n0.232315 0.731117 0.006684 H\n0.232315 0.768883 0.506684 H\n0.767685 0.268883 0.993316 H\n0.497566 0.193631 0.502342 H\n0.502434 0.693631 0.997658 H\n0.502434 0.806369 0.497658 H\n0.497566 0.306369 0.002342 H\n0.039514 0.156360 0.530016 H\n0.960486 0.656360 0.969984 H\n0.960486 0.843640 0.469984 H\n0.039514 0.343640 0.030016 H\n0.991082 0.060094 0.568986 H\n0.008918 0.560094 0.931014 H\n0.008918 0.939906 0.431014 H\n0.991082 0.439906 0.068986 H\n0.390661 0.905111 0.738102 C\n0.609339 0.405111 0.761898 C\n0.609339 0.094889 0.261898 C\n0.390661 0.594889 0.238102 C\n0.340500 0.509674 0.586317 C\n0.659500 0.009674 0.913683 C\n0.659500 0.490326 0.413683 C\n0.340500 0.990326 0.086317 C\n0.042832 0.080330 0.644524 C\n0.957168 0.580330 0.855476 C\n0.957168 0.919670 0.355476 C\n0.042832 0.419670 0.144524 C\n0.721300 0.124899 0.540039 C\n0.278700 0.624899 0.959961 C\n0.278700 0.875101 0.459961 C\n0.721300 0.375101 0.040039 C\n0.572321 0.875444 0.706557 S\n0.427679 0.375444 0.793443 S\n0.427679 0.124556 0.293443 S\n0.572321 0.624556 0.206557 S\n0.549056 0.560407 0.616023 S\n0.450944 0.060407 0.883977 S\n0.450944 0.439593 0.383977 S\n0.549056 0.939593 0.116023 S\n0.067536 0.899968 0.625311 S\n0.932464 0.399968 0.874689 S\n0.932464 0.100032 0.374689 S\n0.067536 0.600032 0.125311 S\n0.533371 0.055982 0.567568 S\n0.466629 0.555982 0.932432 S\n0.466629 0.944018 0.432432 S\n0.533371 0.444018 0.067568 S\n0.848826 0.675202 0.525896 Br\n0.151174 0.175202 0.974104 Br\n0.151174 0.324798 0.474104 Br\n0.848826 0.824798 0.025896 Br\n0.038761 0.509279 0.685791 Br\n0.961239 0.009279 0.814209 Br\n0.961239 0.490721 0.314209 Br\n0.038761 0.990721 0.185791 Br\n0.460054 0.961923 0.768960 N\n0.539946 0.461923 0.731040 N\n0.539946 0.038077 0.231040 N\n0.460054 0.538077 0.268960 N\n0.180027 0.875615 0.733379 N\n0.819973 0.375615 0.766621 N\n0.819973 0.124385 0.266621 N\n0.180027 0.624385 0.233379 N\n0.144731 0.479278 0.597162 N\n0.855269 0.979278 0.902838 N\n0.855269 0.520722 0.402838 N\n0.144731 0.020722 0.097162 N\n0.379194 0.494481 0.552852 N\n0.620806 0.994481 0.947148 N\n0.620806 0.505519 0.447148 N\n0.379194 0.005519 0.052852 N\n0.862908 0.164344 0.639340 N\n0.137092 0.664344 0.860660 N\n0.137092 0.835656 0.360660 N\n0.862908 0.335656 0.139340 N\n0.203672 0.140837 0.664278 N\n0.796328 0.640837 0.835722 N\n0.796328 0.859163 0.335722 N\n0.203672 0.359163 0.164278 N\n0.657181 0.188580 0.509686 N\n0.342819 0.688580 0.990314 N\n0.342819 0.811420 0.490314 N\n0.657181 0.311420 0.009686 N\n0.933913 0.122037 0.548000 N\n0.066087 0.622037 0.952000 N\n0.066087 0.877963 0.452000 N\n0.933913 0.377963 0.048000 N\n",
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}
]
}