Allanatrix/SSB_Dataset · Datasets at Hugging Face

mp_id stringlengths 4 38	elements listlengths 1 10	atomic_numbers listlengths 1 200	num_atoms int32 1 200	num_elements int32 1 10	fractional_coords listlengths 1 200	lattice dict	spacegroup_number int32 0 230	reduced_formula stringlengths 1 24	tier stringclasses 3 values	is_li_containing bool 2 classes	num_li_atoms int32 0 104 ⌀	band_gap float32 0 17.9 ⌀	energy_above_hull float32 0 9.71 ⌀	formation_energy_per_atom float32 -5.15 8.99 ⌀	is_metal bool 2 classes	source_tags listlengths 1 5 ⌀	source stringclasses 4 values
tar:NOMAD_rFp_0cFkWWdT0AfJSRPleACsdyXT	[ "Ga", "Er" ]	[ 68, 31 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.5380468368530273, "b": 3.5380468368530273, "c": 3.5380468368530273, "alpha": 90, "beta": 90, "gamma": 90 }	221	ErGa	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307046	[ "Ir", "Hg" ]	[ 80, 77 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.2698209285736084, "b": 3.2698209285736084, "c": 3.2698209285736084, "alpha": 90, "beta": 90, "gamma": 90 }	221	HgIr	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307062	[ "Li", "Te" ]	[ 3, 52 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.5705881118774414, "b": 3.5705881118774414, "c": 3.5705881118774414, "alpha": 90, "beta": 90, "gamma": 90 }	221	LiTe	general_inorganic	true	1	null	null	null	null	[ "li" ]	external_cif_tar
tar:OQMD_307081	[ "Ce", "Yb" ]	[ 70, 58 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 4.216839790344238, "b": 4.216839790344238, "c": 4.216839790344238, "alpha": 90, "beta": 90, "gamma": 90 }	221	YbCe	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_qUqfJZ8VIRkDrVUDlSmZEoZBHde2	[ "K", "In" ]	[ 19, 49 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 4.247249603271484, "b": 4.247249603271484, "c": 4.247249603271484, "alpha": 90, "beta": 90, "gamma": 90 }	221	KIn	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307114	[ "Ni", "Cd" ]	[ 48, 28 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.114825963973999, "b": 3.114825963973999, "c": 3.114825963973999, "alpha": 90, "beta": 90, "gamma": 90 }	221	CdNi	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_HChokbrPyPOZSp7yBEBTgmtC0yRT	[ "Mo", "Pr" ]	[ 59, 42 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.614739418029785, "b": 3.614739418029785, "c": 3.614739418029785, "alpha": 90, "beta": 90, "gamma": 90 }	221	PrMo	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307149	[ "P", "Ru" ]	[ 15, 44 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 2.951453924179077, "b": 2.951453924179077, "c": 2.951453924179077, "alpha": 90, "beta": 90, "gamma": 90 }	221	PRu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307165	[ "Sc", "Tc" ]	[ 21, 43 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.235482931137085, "b": 3.235482931137085, "c": 3.235482931137085, "alpha": 90, "beta": 90, "gamma": 90 }	221	ScTc	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307179	[ "Co", "Pb" ]	[ 27, 82 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.297487735748291, "b": 3.297487735748291, "c": 3.297487735748291, "alpha": 90, "beta": 90, "gamma": 90 }	221	CoPb	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_F6laOso9ykFmam-gniM0bJVzBip3	[ "Zr", "Dy" ]	[ 66, 40 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.743698835372925, "b": 3.743698835372925, "c": 3.743698835372925, "alpha": 90, "beta": 90, "gamma": 90 }	221	DyZr	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307208	[ "Pr", "Ta" ]	[ 59, 73 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.6686689853668213, "b": 3.6686689853668213, "c": 3.6686689853668213, "alpha": 90, "beta": 90, "gamma": 90 }	221	PrTa	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_6pBmL5tx3cKaofhlD82PRuYsxBkG	[ "V", "Y" ]	[ 39, 23 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.6003060340881348, "b": 3.6003060340881348, "c": 3.6003060340881348, "alpha": 90, "beta": 90, "gamma": 90 }	221	YV	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307243	[ "P", "Gd" ]	[ 64, 15 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.499419927597046, "b": 3.499419927597046, "c": 3.499419927597046, "alpha": 90, "beta": 90, "gamma": 90 }	221	GdP	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307259	[ "Sr", "La" ]	[ 38, 57 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 4.460151195526123, "b": 4.460151195526123, "c": 4.460151195526123, "alpha": 90, "beta": 90, "gamma": 90 }	221	SrLa	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307276	[ "Ag", "Os" ]	[ 47, 76 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.148813009262085, "b": 3.148813009262085, "c": 3.148813009262085, "alpha": 90, "beta": 90, "gamma": 90 }	221	AgOs	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307296	[ "K", "Ni" ]	[ 19, 28 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.8623878955841064, "b": 3.8623878955841064, "c": 3.8623878955841064, "alpha": 90, "beta": 90, "gamma": 90 }	221	KNi	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_0QKEd_-RUtbdIuQDbHp_L6D0HdRj	[ "Sn", "Ce" ]	[ 58, 50 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.9493067264556885, "b": 3.9493067264556885, "c": 3.9493067264556885, "alpha": 90, "beta": 90, "gamma": 90 }	221	CeSn	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307325	[ "Au", "Pb" ]	[ 82, 79 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.6399290561676025, "b": 3.6399290561676025, "c": 3.6399290561676025, "alpha": 90, "beta": 90, "gamma": 90 }	221	PbAu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307339	[ "Fe", "Mo" ]	[ 26, 42 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.003818988800049, "b": 3.003818988800049, "c": 3.003818988800049, "alpha": 90, "beta": 90, "gamma": 90 }	221	FeMo	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_Pi_2eglJLfqjRhqefBtJilZYBPqu	[ "As", "Tm" ]	[ 69, 33 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.5311248302459717, "b": 3.5311248302459717, "c": 3.5311248302459717, "alpha": 90, "beta": 90, "gamma": 90 }	221	TmAs	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307372	[ "Ho", "Ac" ]	[ 89, 67 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 4.2174601554870605, "b": 4.2174601554870605, "c": 4.2174601554870605, "alpha": 90, "beta": 90, "gamma": 90 }	221	AcHo	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307392	[ "Ru", "Dy" ]	[ 66, 44 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.3909730911254883, "b": 3.3909730911254883, "c": 3.3909730911254883, "alpha": 90, "beta": 90, "gamma": 90 }	221	DyRu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307407	[ "Te", "Tl" ]	[ 81, 52 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.964211940765381, "b": 3.964211940765381, "c": 3.964211940765381, "alpha": 90, "beta": 90, "gamma": 90 }	221	TlTe	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307424	[ "F", "Sr" ]	[ 38, 9 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.385673999786377, "b": 3.385673999786377, "c": 3.385673999786377, "alpha": 90, "beta": 90, "gamma": 90 }	221	SrF	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:OQMD_307437	[ "Ge", "Os" ]	[ 32, 76 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.0494298934936523, "b": 3.0494298934936523, "c": 3.0494298934936523, "alpha": 90, "beta": 90, "gamma": 90 }	221	GeOs	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307455	[ "Hg", "Np" ]	[ 93, 80 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.7351529598236084, "b": 3.7351529598236084, "c": 3.7351529598236084, "alpha": 90, "beta": 90, "gamma": 90 }	221	NpHg	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_vojABt2M8dF9WuQ75kM9rnKSzX1b	[ "Ta", "Os" ]	[ 73, 76 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.1872200965881348, "b": 3.1872200965881348, "c": 3.1872200965881348, "alpha": 90, "beta": 90, "gamma": 90 }	221	TaOs	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_zhoRnNOrvRbY3WKHN1zqeLE5Wh3W	[ "Ni", "Bi" ]	[ 28, 83 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.3777801990509033, "b": 3.3777801990509033, "c": 3.3777801990509033, "alpha": 90, "beta": 90, "gamma": 90 }	221	NiBi	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_mMms4jXC9ws9Bt8nLXyn8jhqOEBr	[ "K", "Os" ]	[ 19, 76 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.8187155723571777, "b": 3.8187155723571777, "c": 3.8187155723571777, "alpha": 90, "beta": 90, "gamma": 90 }	221	KOs	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_2WaMg65g8ACdpz68gIrEKRrHW1oO	[ "Lu", "Ac" ]	[ 89, 71 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 4.179423809051514, "b": 4.179423809051514, "c": 4.179423809051514, "alpha": 90, "beta": 90, "gamma": 90 }	221	AcLu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_wx2aC-NPvFOSEVXWyid5dGvuMK_K	[ "Na", "Np" ]	[ 11, 93 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.8688507080078125, "b": 3.8688507080078125, "c": 3.8688507080078125, "alpha": 90, "beta": 90, "gamma": 90 }	221	NaNp	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_f77_nvTMEB9EovjejDSiVzcIf80w	[ "Cu", "Rh" ]	[ 29, 45 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 2.972658634185791, "b": 2.972658634185791, "c": 2.972658634185791, "alpha": 90, "beta": 90, "gamma": 90 }	221	CuRh	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307597	[ "Cu", "Nb" ]	[ 41, 29 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.119913101196289, "b": 3.119913101196289, "c": 3.119913101196289, "alpha": 90, "beta": 90, "gamma": 90 }	221	NbCu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_nZT22pnYqTtNugCOhYxkOc6xsk9l	[ "Zr", "Lu" ]	[ 71, 40 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.7148919105529785, "b": 3.7148919105529785, "c": 3.7148919105529785, "alpha": 90, "beta": 90, "gamma": 90 }	221	LuZr	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307630	[ "Cl", "Ca" ]	[ 20, 17 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.600295066833496, "b": 3.600295066833496, "c": 3.600295066833496, "alpha": 90, "beta": 90, "gamma": 90 }	221	CaCl	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:OQMD_307649	[ "Ce", "Eu" ]	[ 58, 63 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 4.28665018081665, "b": 4.28665018081665, "c": 4.28665018081665, "alpha": 90, "beta": 90, "gamma": 90 }	221	CeEu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307663	[ "Fe", "Tb" ]	[ 65, 26 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.395937919616699, "b": 3.395937919616699, "c": 3.395937919616699, "alpha": 90, "beta": 90, "gamma": 90 }	221	TbFe	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307679	[ "Al", "In" ]	[ 13, 49 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.5327720642089844, "b": 3.5327720642089844, "c": 3.5327720642089844, "alpha": 90, "beta": 90, "gamma": 90 }	221	AlIn	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307698	[ "Gd", "Np" ]	[ 64, 93 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 3.852530002593994, "b": 3.852530002593994, "c": 3.852530002593994, "alpha": 90, "beta": 90, "gamma": 90 }	221	GdNp	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307713	[ "Nb", "Yb" ]	[ 70, 41 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.62191104888916, "b": 3.62191104888916, "c": 3.62191104888916, "alpha": 90, "beta": 90, "gamma": 90 }	221	YbNb	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_UICKWQo0nhbiCG2y8p4fTBl6MxMq	[ "Li", "La" ]	[ 3, 57 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.834470510482788, "b": 3.834470510482788, "c": 3.834470510482788, "alpha": 90, "beta": 90, "gamma": 90 }	221	LiLa	general_inorganic	true	1	null	null	null	null	[ "li" ]	external_cif_tar
tar:OQMD_307751	[ "Nb", "Nd" ]	[ 60, 41 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.654052972793579, "b": 3.654052972793579, "c": 3.654052972793579, "alpha": 90, "beta": 90, "gamma": 90 }	221	NdNb	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_XvejnO2OgbwB0covWGNQJJQrgEpO	[ "Sr", "Ru" ]	[ 38, 44 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.6090128421783447, "b": 3.6090128421783447, "c": 3.6090128421783447, "alpha": 90, "beta": 90, "gamma": 90 }	221	SrRu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307787	[ "Li", "Eu" ]	[ 3, 63 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 4.0524420738220215, "b": 4.0524420738220215, "c": 4.0524420738220215, "alpha": 90, "beta": 90, "gamma": 90 }	221	LiEu	general_inorganic	true	1	null	null	null	null	[ "li" ]	external_cif_tar
tar:NOMAD_T6dNP2pvvmgNQDCDfBq3RS7x7Kwp	[ "H", "Se" ]	[ 1, 34 ]	2	2	[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]	{ "a": 2.8260109424591064, "b": 2.8260109424591064, "c": 2.8260109424591064, "alpha": 90, "beta": 90, "gamma": 90 }	221	HSe	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_307817	[ "Br", "Pb" ]	[ 82, 35 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.890829086303711, "b": 3.890829086303711, "c": 3.890829086303711, "alpha": 90, "beta": 90, "gamma": 90 }	221	PbBr	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:OQMD_307835	[ "F", "Se" ]	[ 34, 9 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 2.9892959594726562, "b": 2.9892959594726562, "c": 2.9892959594726562, "alpha": 90, "beta": 90, "gamma": 90 }	221	SeF	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:NOMAD_GZVAbf5ZhGOsCEikW0zU18xe8cAb	[ "Ru", "Th" ]	[ 90, 44 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.555443525314331, "b": 3.555443525314331, "c": 3.555443525314331, "alpha": 90, "beta": 90, "gamma": 90 }	221	ThRu	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_rfYykpxyn6gUb0veC285AaA2h_Sz	[ "Cl", "Hf" ]	[ 72, 17 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.320990800857544, "b": 3.320990800857544, "c": 3.320990800857544, "alpha": 90, "beta": 90, "gamma": 90 }	221	HfCl	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:OQMD_307884	[ "Pm", "Hf" ]	[ 61, 72 ]	2	2	[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]	{ "a": 3.7649500370025635, "b": 3.7649500370025635, "c": 3.7649500370025635, "alpha": 90, "beta": 90, "gamma": 90 }	221	PmHf	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_YxR3Swl6Q7m-PxxMmBoEPOrUbgMP	[ "O", "Re" ]	[ 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 8, 8, 8, 8 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.0118255615234375, "b": 6.0118255615234375, "c": 6.0118255615234375, "alpha": 90, "beta": 90, "gamma": 90 }	225	Re3O	general_inorganic	false	null	null	null	null	null	[ "oxide" ]	external_cif_tar
tar:OQMD_307930	[ "Ce", "Er" ]	[ 58, 58, 58, 58, 58, 58, 58, 58, 58, 58, 58, 58, 68, 68, 68, 68 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 8.286211967468262, "b": 8.286211967468262, "c": 8.286211967468262, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ce3Er	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_bWujhcPeIvQHrajlLMdnRgR7KxMI	[ "Cl", "Ni" ]	[ 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 17, 17, 17, 17 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 5.841935634613037, "b": 5.841935634613037, "c": 5.841935634613037, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ni3Cl	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:NOMAD_uPeiBv09qaOveOdGZiNuY5s_h2va	[ "B", "Pa" ]	[ 91, 91, 91, 91, 91, 91, 91, 91, 91, 91, 91, 91, 5, 5, 5, 5 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.803782939910889, "b": 6.803782939910889, "c": 6.803782939910889, "alpha": 90, "beta": 90, "gamma": 90 }	225	Pa3B	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_cnZRFx_3FGM19AskoBDDl01zI7jl	[ "Al", "La" ]	[ 57, 57, 57, 57, 57, 57, 57, 57, 57, 57, 57, 57, 13, 13, 13, 13 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 7.884247779846191, "b": 7.884247779846191, "c": 7.884247779846191, "alpha": 90, "beta": 90, "gamma": 90 }	225	La3Al	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_EE_CB-Wz6gAlJ1G44H4sM4zy1JIy	[ "Nd", "Gd" ]	[ 60, 60, 60, 60, 64, 64, 64, 64, 64, 64, 64, 64, 64, 64, 64, 64 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 8.096729278564453, "b": 8.096729278564453, "c": 8.096729278564453, "alpha": 90, "beta": 90, "gamma": 90 }	225	NdGd3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308011	[ "Pd", "Ag" ]	[ 47, 47, 47, 47, 46, 46, 46, 46, 46, 46, 46, 46, 46, 46, 46, 46 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.199888229370117, "b": 6.199888229370117, "c": 6.199888229370117, "alpha": 90, "beta": 90, "gamma": 90 }	225	AgPd3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_p5duY5fnVRdpj4ih0GdJ_dXPqCm8	[ "Ca", "Cr" ]	[ 20, 20, 20, 20, 20, 20, 20, 20, 20, 20, 20, 20, 24, 24, 24, 24 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 7.923303127288818, "b": 7.923303127288818, "c": 7.923303127288818, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ca3Cr	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308046	[ "N", "Yb" ]	[ 70, 70, 70, 70, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 5.407666206359863, "b": 5.407666206359863, "c": 5.407666206359863, "alpha": 90, "beta": 90, "gamma": 90 }	225	YbN3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308069	[ "Pr", "Pa" ]	[ 59, 59, 59, 59, 59, 59, 59, 59, 59, 59, 59, 59, 91, 91, 91, 91 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 8.082205772399902, "b": 8.082205772399902, "c": 8.082205772399902, "alpha": 90, "beta": 90, "gamma": 90 }	225	Pr3Pa	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308082	[ "Fe", "Er" ]	[ 68, 68, 68, 68, 26, 26, 26, 26, 26, 26, 26, 26, 26, 26, 26, 26 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.1466498374938965, "b": 6.1466498374938965, "c": 6.1466498374938965, "alpha": 90, "beta": 90, "gamma": 90 }	225	ErFe3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308092	[ "N", "Cd" ]	[ 48, 48, 48, 48, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 5.453864097595215, "b": 5.453864097595215, "c": 5.453864097595215, "alpha": 90, "beta": 90, "gamma": 90 }	225	CdN3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308108	[ "Sb", "Os" ]	[ 51, 51, 51, 51, 76, 76, 76, 76, 76, 76, 76, 76, 76, 76, 76, 76 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.344597816467285, "b": 6.344597816467285, "c": 6.344597816467285, "alpha": 90, "beta": 90, "gamma": 90 }	225	SbOs3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308129	[ "Sn", "Re" ]	[ 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 50, 50, 50, 50 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.356267929077148, "b": 6.356267929077148, "c": 6.356267929077148, "alpha": 90, "beta": 90, "gamma": 90 }	225	Re3Sn	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308143	[ "Te", "Re" ]	[ 75, 75, 75, 75, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.115362167358398, "b": 7.115362167358398, "c": 7.115362167358398, "alpha": 90, "beta": 90, "gamma": 90 }	225	ReTe3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_y3gYUSAZ6lV98viA_IQUMfTT2Xwl	[ "P", "Sb" ]	[ 51, 51, 51, 51, 15, 15, 15, 15, 15, 15, 15, 15, 15, 15, 15, 15 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.5461955070495605, "b": 6.5461955070495605, "c": 6.5461955070495605, "alpha": 90, "beta": 90, "gamma": 90 }	225	SbP3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308178	[ "In", "Pm" ]	[ 61, 61, 61, 61, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.419950008392334, "b": 7.419950008392334, "c": 7.419950008392334, "alpha": 90, "beta": 90, "gamma": 90 }	225	PmIn3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308189	[ "C", "Np" ]	[ 93, 93, 93, 93, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 5.4036359786987305, "b": 5.4036359786987305, "c": 5.4036359786987305, "alpha": 90, "beta": 90, "gamma": 90 }	225	NpC3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308199	[ "Ru", "Hf" ]	[ 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 44, 44, 44, 44 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.724224090576172, "b": 6.724224090576172, "c": 6.724224090576172, "alpha": 90, "beta": 90, "gamma": 90 }	225	Hf3Ru	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308215	[ "Rb", "Th" ]	[ 37, 37, 37, 37, 90, 90, 90, 90, 90, 90, 90, 90, 90, 90, 90, 90 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 8.327825546264648, "b": 8.327825546264648, "c": 8.327825546264648, "alpha": 90, "beta": 90, "gamma": 90 }	225	RbTh3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308248	[ "Co", "Ni" ]	[ 27, 27, 27, 27, 27, 27, 27, 27, 27, 27, 27, 27, 28, 28, 28, 28 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 5.585912227630615, "b": 5.585912227630615, "c": 5.585912227630615, "alpha": 90, "beta": 90, "gamma": 90 }	225	Co3Ni	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308262	[ "Hf", "Np" ]	[ 72, 72, 72, 72, 93, 93, 93, 93, 93, 93, 93, 93, 93, 93, 93, 93 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.865190029144287, "b": 6.865190029144287, "c": 6.865190029144287, "alpha": 90, "beta": 90, "gamma": 90 }	225	HfNp3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:NOMAD_RLRcSs-r7W71M_JuNYlSlJ2xRFbA	[ "B", "Pa" ]	[ 91, 91, 91, 91, 5, 5, 5, 5, 5, 5, 5, 5, 5, 5, 5, 5 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 5.657987594604492, "b": 5.657987594604492, "c": 5.657987594604492, "alpha": 90, "beta": 90, "gamma": 90 }	225	PaB3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308302	[ "Nd", "Re" ]	[ 60, 60, 60, 60, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.544067859649658, "b": 6.544067859649658, "c": 6.544067859649658, "alpha": 90, "beta": 90, "gamma": 90 }	225	NdRe3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308314	[ "Ni", "I" ]	[ 28, 28, 28, 28, 53, 53, 53, 53, 53, 53, 53, 53, 53, 53, 53, 53 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.715000152587891, "b": 7.715000152587891, "c": 7.715000152587891, "alpha": 90, "beta": 90, "gamma": 90 }	225	NiI3	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:OQMD_308332	[ "Br", "Y" ]	[ 39, 39, 39, 39, 35, 35, 35, 35, 35, 35, 35, 35, 35, 35, 35, 35 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.339077949523926, "b": 7.339077949523926, "c": 7.339077949523926, "alpha": 90, "beta": 90, "gamma": 90 }	225	YBr3	general_inorganic	false	null	null	null	null	null	[ "halide" ]	external_cif_tar
tar:OQMD_308346	[ "Te", "Er" ]	[ 68, 68, 68, 68, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.675072193145752, "b": 7.675072193145752, "c": 7.675072193145752, "alpha": 90, "beta": 90, "gamma": 90 }	225	ErTe3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308359	[ "Ba", "Tb" ]	[ 56, 56, 56, 56, 65, 65, 65, 65, 65, 65, 65, 65, 65, 65, 65, 65 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 8.373627662658691, "b": 8.373627662658691, "c": 8.373627662658691, "alpha": 90, "beta": 90, "gamma": 90 }	225	BaTb3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308374	[ "Ni", "Rb" ]	[ 37, 37, 37, 37, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.374450206756592, "b": 6.374450206756592, "c": 6.374450206756592, "alpha": 90, "beta": 90, "gamma": 90 }	225	RbNi3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308390	[ "Al", "Fe" ]	[ 13, 13, 13, 13, 13, 13, 13, 13, 13, 13, 13, 13, 26, 26, 26, 26 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 5.971757888793945, "b": 5.971757888793945, "c": 5.971757888793945, "alpha": 90, "beta": 90, "gamma": 90 }	225	Al3Fe	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308408	[ "Ga", "Rh" ]	[ 31, 31, 31, 31, 45, 45, 45, 45, 45, 45, 45, 45, 45, 45, 45, 45 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.136442184448242, "b": 6.136442184448242, "c": 6.136442184448242, "alpha": 90, "beta": 90, "gamma": 90 }	225	GaRh3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308426	[ "Be", "Ga" ]	[ 4, 4, 4, 4, 31, 31, 31, 31, 31, 31, 31, 31, 31, 31, 31, 31 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.2991862297058105, "b": 6.2991862297058105, "c": 6.2991862297058105, "alpha": 90, "beta": 90, "gamma": 90 }	225	BeGa3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308440	[ "Sn", "Ac" ]	[ 89, 89, 89, 89, 89, 89, 89, 89, 89, 89, 89, 89, 50, 50, 50, 50 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 8.421321868896484, "b": 8.421321868896484, "c": 8.421321868896484, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ac3Sn	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308456	[ "Y", "Hf" ]	[ 39, 39, 39, 39, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.249924182891846, "b": 7.249924182891846, "c": 7.249924182891846, "alpha": 90, "beta": 90, "gamma": 90 }	225	YHf3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308473	[ "Sr", "Sb" ]	[ 38, 38, 38, 38, 51, 51, 51, 51, 51, 51, 51, 51, 51, 51, 51, 51 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.882966041564941, "b": 7.882966041564941, "c": 7.882966041564941, "alpha": 90, "beta": 90, "gamma": 90 }	225	SrSb3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308484	[ "Ti", "Se" ]	[ 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 34, 34, 34, 34 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.321564197540283, "b": 6.321564197540283, "c": 6.321564197540283, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ti3Se	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308495	[ "Ta", "Tl" ]	[ 73, 73, 73, 73, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 7.229844093322754, "b": 7.229844093322754, "c": 7.229844093322754, "alpha": 90, "beta": 90, "gamma": 90 }	225	TaTl3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308514	[ "Si", "Se" ]	[ 14, 14, 14, 14, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.775847911834717, "b": 6.775847911834717, "c": 6.775847911834717, "alpha": 90, "beta": 90, "gamma": 90 }	225	SiSe3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308530	[ "Zn", "Tl" ]	[ 81, 81, 81, 81, 30, 30, 30, 30, 30, 30, 30, 30, 30, 30, 30, 30 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 6.639614105224609, "b": 6.639614105224609, "c": 6.639614105224609, "alpha": 90, "beta": 90, "gamma": 90 }	225	TlZn3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308551	[ "Ba", "Gd" ]	[ 56, 56, 56, 56, 56, 56, 56, 56, 56, 56, 56, 56, 64, 64, 64, 64 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 9.382218360900879, "b": 9.382218360900879, "c": 9.382218360900879, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ba3Gd	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308566	[ "C", "Ti" ]	[ 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 6, 6, 6, 6 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 5.859618186950684, "b": 5.859618186950684, "c": 5.859618186950684, "alpha": 90, "beta": 90, "gamma": 90 }	225	Ti3C	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308579	[ "Rh", "Yb" ]	[ 70, 70, 70, 70, 70, 70, 70, 70, 70, 70, 70, 70, 45, 45, 45, 45 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 7.275269985198975, "b": 7.275269985198975, "c": 7.275269985198975, "alpha": 90, "beta": 90, "gamma": 90 }	225	Yb3Rh	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308597	[ "O", "Ti" ]	[ 22, 22, 22, 22, 8, 8, 8, 8, 8, 8, 8, 8, 8, 8, 8, 8 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 5.074292182922363, "b": 5.074292182922363, "c": 5.074292182922363, "alpha": 90, "beta": 90, "gamma": 90 }	225	TiO3	general_inorganic	false	null	null	null	null	null	[ "oxide" ]	external_cif_tar
tar:OQMD_308608	[ "Se", "Tm" ]	[ 69, 69, 69, 69, 69, 69, 69, 69, 69, 69, 69, 69, 34, 34, 34, 34 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 7.487847805023193, "b": 7.487847805023193, "c": 7.487847805023193, "alpha": 90, "beta": 90, "gamma": 90 }	225	Tm3Se	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308627	[ "Rh", "Dy" ]	[ 66, 66, 66, 66, 66, 66, 66, 66, 66, 66, 66, 66, 45, 45, 45, 45 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 7.265965938568115, "b": 7.265965938568115, "c": 7.265965938568115, "alpha": 90, "beta": 90, "gamma": 90 }	225	Dy3Rh	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308641	[ "Pt", "Tl" ]	[ 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 78, 78, 78, 78 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 7.134511947631836, "b": 7.134511947631836, "c": 7.134511947631836, "alpha": 90, "beta": 90, "gamma": 90 }	225	Tl3Pt	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308656	[ "Si", "Mo" ]	[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 42, 42, 42, 42 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.0975141525268555, "b": 6.0975141525268555, "c": 6.0975141525268555, "alpha": 90, "beta": 90, "gamma": 90 }	225	Si3Mo	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308667	[ "Be", "Si" ]	[ 4, 4, 4, 4, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14 ]	16	2	[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...	{ "a": 5.945695877075195, "b": 5.945695877075195, "c": 5.945695877075195, "alpha": 90, "beta": 90, "gamma": 90 }	225	BeSi3	general_inorganic	false	null	null	null	null	null	null	external_cif_tar
tar:OQMD_308681	[ "Sc", "Co" ]	[ 21, 21, 21, 21, 21, 21, 21, 21, 21, 21, 21, 21, 27, 27, 27, 27 ]	16	2	[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...	{ "a": 6.7125701904296875, "b": 6.7125701904296875, "c": 6.7125701904296875, "alpha": 90, "beta": 90, "gamma": 90 }	225	Sc3Co	general_inorganic	false	null	null	null	null	null	null	external_cif_tar

tar:NOMAD_rFp_0cFkWWdT0AfJSRPleACsdyXT

[ "Ga", "Er" ]

[ 68, 31 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.5380468368530273, "b": 3.5380468368530273, "c": 3.5380468368530273, "alpha": 90, "beta": 90, "gamma": 90 }

221

ErGa

general_inorganic

false

null

external_cif_tar

tar:OQMD_307046

[ "Ir", "Hg" ]

[ 80, 77 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.2698209285736084, "b": 3.2698209285736084, "c": 3.2698209285736084, "alpha": 90, "beta": 90, "gamma": 90 }

221

HgIr

general_inorganic

false

null

external_cif_tar

tar:OQMD_307062

[ "Li", "Te" ]

[ 3, 52 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.5705881118774414, "b": 3.5705881118774414, "c": 3.5705881118774414, "alpha": 90, "beta": 90, "gamma": 90 }

221

LiTe

general_inorganic

true

1

null

[ "li" ]

external_cif_tar

tar:OQMD_307081

[ "Ce", "Yb" ]

[ 70, 58 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 4.216839790344238, "b": 4.216839790344238, "c": 4.216839790344238, "alpha": 90, "beta": 90, "gamma": 90 }

221

YbCe

general_inorganic

false

null

external_cif_tar

tar:NOMAD_qUqfJZ8VIRkDrVUDlSmZEoZBHde2

[ "K", "In" ]

[ 19, 49 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 4.247249603271484, "b": 4.247249603271484, "c": 4.247249603271484, "alpha": 90, "beta": 90, "gamma": 90 }

221

KIn

general_inorganic

false

null

external_cif_tar

tar:OQMD_307114

[ "Ni", "Cd" ]

[ 48, 28 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.114825963973999, "b": 3.114825963973999, "c": 3.114825963973999, "alpha": 90, "beta": 90, "gamma": 90 }

221

CdNi

general_inorganic

false

null

external_cif_tar

tar:NOMAD_HChokbrPyPOZSp7yBEBTgmtC0yRT

[ "Mo", "Pr" ]

[ 59, 42 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.614739418029785, "b": 3.614739418029785, "c": 3.614739418029785, "alpha": 90, "beta": 90, "gamma": 90 }

221

PrMo

general_inorganic

false

null

external_cif_tar

tar:OQMD_307149

[ "P", "Ru" ]

[ 15, 44 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 2.951453924179077, "b": 2.951453924179077, "c": 2.951453924179077, "alpha": 90, "beta": 90, "gamma": 90 }

221

PRu

general_inorganic

false

null

external_cif_tar

tar:OQMD_307165

[ "Sc", "Tc" ]

[ 21, 43 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.235482931137085, "b": 3.235482931137085, "c": 3.235482931137085, "alpha": 90, "beta": 90, "gamma": 90 }

221

ScTc

general_inorganic

false

null

external_cif_tar

tar:OQMD_307179

[ "Co", "Pb" ]

[ 27, 82 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.297487735748291, "b": 3.297487735748291, "c": 3.297487735748291, "alpha": 90, "beta": 90, "gamma": 90 }

221

CoPb

general_inorganic

false

null

external_cif_tar

tar:NOMAD_F6laOso9ykFmam-gniM0bJVzBip3

[ "Zr", "Dy" ]

[ 66, 40 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.743698835372925, "b": 3.743698835372925, "c": 3.743698835372925, "alpha": 90, "beta": 90, "gamma": 90 }

221

DyZr

general_inorganic

false

null

external_cif_tar

tar:OQMD_307208

[ "Pr", "Ta" ]

[ 59, 73 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.6686689853668213, "b": 3.6686689853668213, "c": 3.6686689853668213, "alpha": 90, "beta": 90, "gamma": 90 }

221

PrTa

general_inorganic

false

null

external_cif_tar

tar:NOMAD_6pBmL5tx3cKaofhlD82PRuYsxBkG

[ "V", "Y" ]

[ 39, 23 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.6003060340881348, "b": 3.6003060340881348, "c": 3.6003060340881348, "alpha": 90, "beta": 90, "gamma": 90 }

221

YV

general_inorganic

false

null

external_cif_tar

tar:OQMD_307243

[ "P", "Gd" ]

[ 64, 15 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.499419927597046, "b": 3.499419927597046, "c": 3.499419927597046, "alpha": 90, "beta": 90, "gamma": 90 }

221

GdP

general_inorganic

false

null

external_cif_tar

tar:OQMD_307259

[ "Sr", "La" ]

[ 38, 57 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 4.460151195526123, "b": 4.460151195526123, "c": 4.460151195526123, "alpha": 90, "beta": 90, "gamma": 90 }

221

SrLa

general_inorganic

false

null

external_cif_tar

tar:OQMD_307276

[ "Ag", "Os" ]

[ 47, 76 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.148813009262085, "b": 3.148813009262085, "c": 3.148813009262085, "alpha": 90, "beta": 90, "gamma": 90 }

221

AgOs

general_inorganic

false

null

external_cif_tar

tar:OQMD_307296

[ "K", "Ni" ]

[ 19, 28 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.8623878955841064, "b": 3.8623878955841064, "c": 3.8623878955841064, "alpha": 90, "beta": 90, "gamma": 90 }

221

KNi

general_inorganic

false

null

external_cif_tar

tar:NOMAD_0QKEd_-RUtbdIuQDbHp_L6D0HdRj

[ "Sn", "Ce" ]

[ 58, 50 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.9493067264556885, "b": 3.9493067264556885, "c": 3.9493067264556885, "alpha": 90, "beta": 90, "gamma": 90 }

221

CeSn

general_inorganic

false

null

external_cif_tar

tar:OQMD_307325

[ "Au", "Pb" ]

[ 82, 79 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.6399290561676025, "b": 3.6399290561676025, "c": 3.6399290561676025, "alpha": 90, "beta": 90, "gamma": 90 }

221

PbAu

general_inorganic

false

null

external_cif_tar

tar:OQMD_307339

[ "Fe", "Mo" ]

[ 26, 42 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.003818988800049, "b": 3.003818988800049, "c": 3.003818988800049, "alpha": 90, "beta": 90, "gamma": 90 }

221

FeMo

general_inorganic

false

null

external_cif_tar

tar:NOMAD_Pi_2eglJLfqjRhqefBtJilZYBPqu

[ "As", "Tm" ]

[ 69, 33 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.5311248302459717, "b": 3.5311248302459717, "c": 3.5311248302459717, "alpha": 90, "beta": 90, "gamma": 90 }

221

TmAs

general_inorganic

false

null

external_cif_tar

tar:OQMD_307372

[ "Ho", "Ac" ]

[ 89, 67 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 4.2174601554870605, "b": 4.2174601554870605, "c": 4.2174601554870605, "alpha": 90, "beta": 90, "gamma": 90 }

221

AcHo

general_inorganic

false

null

external_cif_tar

tar:OQMD_307392

[ "Ru", "Dy" ]

[ 66, 44 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.3909730911254883, "b": 3.3909730911254883, "c": 3.3909730911254883, "alpha": 90, "beta": 90, "gamma": 90 }

221

DyRu

general_inorganic

false

null

external_cif_tar

tar:OQMD_307407

[ "Te", "Tl" ]

[ 81, 52 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.964211940765381, "b": 3.964211940765381, "c": 3.964211940765381, "alpha": 90, "beta": 90, "gamma": 90 }

221

TlTe

general_inorganic

false

null

external_cif_tar

tar:OQMD_307424

[ "F", "Sr" ]

[ 38, 9 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.385673999786377, "b": 3.385673999786377, "c": 3.385673999786377, "alpha": 90, "beta": 90, "gamma": 90 }

221

SrF

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:OQMD_307437

[ "Ge", "Os" ]

[ 32, 76 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.0494298934936523, "b": 3.0494298934936523, "c": 3.0494298934936523, "alpha": 90, "beta": 90, "gamma": 90 }

221

GeOs

general_inorganic

false

null

external_cif_tar

tar:OQMD_307455

[ "Hg", "Np" ]

[ 93, 80 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.7351529598236084, "b": 3.7351529598236084, "c": 3.7351529598236084, "alpha": 90, "beta": 90, "gamma": 90 }

221

NpHg

general_inorganic

false

null

external_cif_tar

tar:NOMAD_vojABt2M8dF9WuQ75kM9rnKSzX1b

[ "Ta", "Os" ]

[ 73, 76 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.1872200965881348, "b": 3.1872200965881348, "c": 3.1872200965881348, "alpha": 90, "beta": 90, "gamma": 90 }

221

TaOs

general_inorganic

false

null

external_cif_tar

tar:NOMAD_zhoRnNOrvRbY3WKHN1zqeLE5Wh3W

[ "Ni", "Bi" ]

[ 28, 83 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.3777801990509033, "b": 3.3777801990509033, "c": 3.3777801990509033, "alpha": 90, "beta": 90, "gamma": 90 }

221

NiBi

general_inorganic

false

null

external_cif_tar

tar:NOMAD_mMms4jXC9ws9Bt8nLXyn8jhqOEBr

[ "K", "Os" ]

[ 19, 76 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.8187155723571777, "b": 3.8187155723571777, "c": 3.8187155723571777, "alpha": 90, "beta": 90, "gamma": 90 }

221

KOs

general_inorganic

false

null

external_cif_tar

tar:NOMAD_2WaMg65g8ACdpz68gIrEKRrHW1oO

[ "Lu", "Ac" ]

[ 89, 71 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 4.179423809051514, "b": 4.179423809051514, "c": 4.179423809051514, "alpha": 90, "beta": 90, "gamma": 90 }

221

AcLu

general_inorganic

false

null

external_cif_tar

tar:NOMAD_wx2aC-NPvFOSEVXWyid5dGvuMK_K

[ "Na", "Np" ]

[ 11, 93 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.8688507080078125, "b": 3.8688507080078125, "c": 3.8688507080078125, "alpha": 90, "beta": 90, "gamma": 90 }

221

NaNp

general_inorganic

false

null

external_cif_tar

tar:NOMAD_f77_nvTMEB9EovjejDSiVzcIf80w

[ "Cu", "Rh" ]

[ 29, 45 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 2.972658634185791, "b": 2.972658634185791, "c": 2.972658634185791, "alpha": 90, "beta": 90, "gamma": 90 }

221

CuRh

general_inorganic

false

null

external_cif_tar

tar:OQMD_307597

[ "Cu", "Nb" ]

[ 41, 29 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.119913101196289, "b": 3.119913101196289, "c": 3.119913101196289, "alpha": 90, "beta": 90, "gamma": 90 }

221

NbCu

general_inorganic

false

null

external_cif_tar

tar:NOMAD_nZT22pnYqTtNugCOhYxkOc6xsk9l

[ "Zr", "Lu" ]

[ 71, 40 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.7148919105529785, "b": 3.7148919105529785, "c": 3.7148919105529785, "alpha": 90, "beta": 90, "gamma": 90 }

221

LuZr

general_inorganic

false

null

external_cif_tar

tar:OQMD_307630

[ "Cl", "Ca" ]

[ 20, 17 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.600295066833496, "b": 3.600295066833496, "c": 3.600295066833496, "alpha": 90, "beta": 90, "gamma": 90 }

221

CaCl

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:OQMD_307649

[ "Ce", "Eu" ]

[ 58, 63 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 4.28665018081665, "b": 4.28665018081665, "c": 4.28665018081665, "alpha": 90, "beta": 90, "gamma": 90 }

221

CeEu

general_inorganic

false

null

external_cif_tar

tar:OQMD_307663

[ "Fe", "Tb" ]

[ 65, 26 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.395937919616699, "b": 3.395937919616699, "c": 3.395937919616699, "alpha": 90, "beta": 90, "gamma": 90 }

221

TbFe

general_inorganic

false

null

external_cif_tar

tar:OQMD_307679

[ "Al", "In" ]

[ 13, 49 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.5327720642089844, "b": 3.5327720642089844, "c": 3.5327720642089844, "alpha": 90, "beta": 90, "gamma": 90 }

221

AlIn

general_inorganic

false

null

external_cif_tar

tar:OQMD_307698

[ "Gd", "Np" ]

[ 64, 93 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 3.852530002593994, "b": 3.852530002593994, "c": 3.852530002593994, "alpha": 90, "beta": 90, "gamma": 90 }

221

GdNp

general_inorganic

false

null

external_cif_tar

tar:OQMD_307713

[ "Nb", "Yb" ]

[ 70, 41 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.62191104888916, "b": 3.62191104888916, "c": 3.62191104888916, "alpha": 90, "beta": 90, "gamma": 90 }

221

YbNb

general_inorganic

false

null

external_cif_tar

tar:NOMAD_UICKWQo0nhbiCG2y8p4fTBl6MxMq

[ "Li", "La" ]

[ 3, 57 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.834470510482788, "b": 3.834470510482788, "c": 3.834470510482788, "alpha": 90, "beta": 90, "gamma": 90 }

221

LiLa

general_inorganic

true

1

null

[ "li" ]

external_cif_tar

tar:OQMD_307751

[ "Nb", "Nd" ]

[ 60, 41 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.654052972793579, "b": 3.654052972793579, "c": 3.654052972793579, "alpha": 90, "beta": 90, "gamma": 90 }

221

NdNb

general_inorganic

false

null

external_cif_tar

tar:NOMAD_XvejnO2OgbwB0covWGNQJJQrgEpO

[ "Sr", "Ru" ]

[ 38, 44 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.6090128421783447, "b": 3.6090128421783447, "c": 3.6090128421783447, "alpha": 90, "beta": 90, "gamma": 90 }

221

SrRu

general_inorganic

false

null

external_cif_tar

tar:OQMD_307787

[ "Li", "Eu" ]

[ 3, 63 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 4.0524420738220215, "b": 4.0524420738220215, "c": 4.0524420738220215, "alpha": 90, "beta": 90, "gamma": 90 }

221

LiEu

general_inorganic

true

1

null

[ "li" ]

external_cif_tar

tar:NOMAD_T6dNP2pvvmgNQDCDfBq3RS7x7Kwp

[ "H", "Se" ]

[ 1, 34 ]

2

[ [ 0, 0, 0 ], [ 0.5, 0.5, 0.5 ] ]

{ "a": 2.8260109424591064, "b": 2.8260109424591064, "c": 2.8260109424591064, "alpha": 90, "beta": 90, "gamma": 90 }

221

HSe

general_inorganic

false

null

external_cif_tar

tar:OQMD_307817

[ "Br", "Pb" ]

[ 82, 35 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.890829086303711, "b": 3.890829086303711, "c": 3.890829086303711, "alpha": 90, "beta": 90, "gamma": 90 }

221

PbBr

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:OQMD_307835

[ "F", "Se" ]

[ 34, 9 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 2.9892959594726562, "b": 2.9892959594726562, "c": 2.9892959594726562, "alpha": 90, "beta": 90, "gamma": 90 }

221

SeF

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:NOMAD_GZVAbf5ZhGOsCEikW0zU18xe8cAb

[ "Ru", "Th" ]

[ 90, 44 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.555443525314331, "b": 3.555443525314331, "c": 3.555443525314331, "alpha": 90, "beta": 90, "gamma": 90 }

221

ThRu

general_inorganic

false

null

external_cif_tar

tar:NOMAD_rfYykpxyn6gUb0veC285AaA2h_Sz

[ "Cl", "Hf" ]

[ 72, 17 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.320990800857544, "b": 3.320990800857544, "c": 3.320990800857544, "alpha": 90, "beta": 90, "gamma": 90 }

221

HfCl

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:OQMD_307884

[ "Pm", "Hf" ]

[ 61, 72 ]

2

[ [ 0.5, 0.5, 0.5 ], [ 0, 0, 0 ] ]

{ "a": 3.7649500370025635, "b": 3.7649500370025635, "c": 3.7649500370025635, "alpha": 90, "beta": 90, "gamma": 90 }

221

PmHf

general_inorganic

false

null

external_cif_tar

tar:NOMAD_YxR3Swl6Q7m-PxxMmBoEPOrUbgMP

[ "O", "Re" ]

[ 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 8, 8, 8, 8 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 6.0118255615234375, "b": 6.0118255615234375, "c": 6.0118255615234375, "alpha": 90, "beta": 90, "gamma": 90 }

225

Re3O

general_inorganic

false

null

[ "oxide" ]

external_cif_tar

tar:OQMD_307930

[ "Ce", "Er" ]

[ 58, 58, 58, 58, 58, 58, 58, 58, 58, 58, 58, 58, 68, 68, 68, 68 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 8.286211967468262, "b": 8.286211967468262, "c": 8.286211967468262, "alpha": 90, "beta": 90, "gamma": 90 }

225

Ce3Er

general_inorganic

false

null

external_cif_tar

tar:NOMAD_bWujhcPeIvQHrajlLMdnRgR7KxMI

[ "Cl", "Ni" ]

[ 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 17, 17, 17, 17 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 5.841935634613037, "b": 5.841935634613037, "c": 5.841935634613037, "alpha": 90, "beta": 90, "gamma": 90 }

225

Ni3Cl

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:NOMAD_uPeiBv09qaOveOdGZiNuY5s_h2va

[ "B", "Pa" ]

[ 91, 91, 91, 91, 91, 91, 91, 91, 91, 91, 91, 91, 5, 5, 5, 5 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 6.803782939910889, "b": 6.803782939910889, "c": 6.803782939910889, "alpha": 90, "beta": 90, "gamma": 90 }

225

Pa3B

general_inorganic

false

null

external_cif_tar

tar:NOMAD_cnZRFx_3FGM19AskoBDDl01zI7jl

[ "Al", "La" ]

[ 57, 57, 57, 57, 57, 57, 57, 57, 57, 57, 57, 57, 13, 13, 13, 13 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 7.884247779846191, "b": 7.884247779846191, "c": 7.884247779846191, "alpha": 90, "beta": 90, "gamma": 90 }

225

La3Al

general_inorganic

false

null

external_cif_tar

tar:NOMAD_EE_CB-Wz6gAlJ1G44H4sM4zy1JIy

[ "Nd", "Gd" ]

[ 60, 60, 60, 60, 64, 64, 64, 64, 64, 64, 64, 64, 64, 64, 64, 64 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 8.096729278564453, "b": 8.096729278564453, "c": 8.096729278564453, "alpha": 90, "beta": 90, "gamma": 90 }

225

NdGd3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308011

[ "Pd", "Ag" ]

[ 47, 47, 47, 47, 46, 46, 46, 46, 46, 46, 46, 46, 46, 46, 46, 46 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 6.199888229370117, "b": 6.199888229370117, "c": 6.199888229370117, "alpha": 90, "beta": 90, "gamma": 90 }

225

AgPd3

general_inorganic

false

null

external_cif_tar

tar:NOMAD_p5duY5fnVRdpj4ih0GdJ_dXPqCm8

[ "Ca", "Cr" ]

[ 20, 20, 20, 20, 20, 20, 20, 20, 20, 20, 20, 20, 24, 24, 24, 24 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 7.923303127288818, "b": 7.923303127288818, "c": 7.923303127288818, "alpha": 90, "beta": 90, "gamma": 90 }

225

Ca3Cr

general_inorganic

false

null

external_cif_tar

tar:OQMD_308046

[ "N", "Yb" ]

[ 70, 70, 70, 70, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 5.407666206359863, "b": 5.407666206359863, "c": 5.407666206359863, "alpha": 90, "beta": 90, "gamma": 90 }

225

YbN3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308069

[ "Pr", "Pa" ]

[ 59, 59, 59, 59, 59, 59, 59, 59, 59, 59, 59, 59, 91, 91, 91, 91 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 8.082205772399902, "b": 8.082205772399902, "c": 8.082205772399902, "alpha": 90, "beta": 90, "gamma": 90 }

225

Pr3Pa

general_inorganic

false

null

external_cif_tar

tar:OQMD_308082

[ "Fe", "Er" ]

[ 68, 68, 68, 68, 26, 26, 26, 26, 26, 26, 26, 26, 26, 26, 26, 26 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 6.1466498374938965, "b": 6.1466498374938965, "c": 6.1466498374938965, "alpha": 90, "beta": 90, "gamma": 90 }

225

ErFe3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308092

[ "N", "Cd" ]

[ 48, 48, 48, 48, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7, 7 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 5.453864097595215, "b": 5.453864097595215, "c": 5.453864097595215, "alpha": 90, "beta": 90, "gamma": 90 }

225

CdN3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308108

[ "Sb", "Os" ]

[ 51, 51, 51, 51, 76, 76, 76, 76, 76, 76, 76, 76, 76, 76, 76, 76 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 6.344597816467285, "b": 6.344597816467285, "c": 6.344597816467285, "alpha": 90, "beta": 90, "gamma": 90 }

225

SbOs3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308129

[ "Sn", "Re" ]

[ 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 50, 50, 50, 50 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 6.356267929077148, "b": 6.356267929077148, "c": 6.356267929077148, "alpha": 90, "beta": 90, "gamma": 90 }

225

Re3Sn

general_inorganic

false

null

external_cif_tar

tar:OQMD_308143

[ "Te", "Re" ]

[ 75, 75, 75, 75, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 7.115362167358398, "b": 7.115362167358398, "c": 7.115362167358398, "alpha": 90, "beta": 90, "gamma": 90 }

225

ReTe3

general_inorganic

false

null

external_cif_tar

tar:NOMAD_y3gYUSAZ6lV98viA_IQUMfTT2Xwl

[ "P", "Sb" ]

[ 51, 51, 51, 51, 15, 15, 15, 15, 15, 15, 15, 15, 15, 15, 15, 15 ]

16

2

[ [ 0, 0, 0 ], [ 0, 0.5, 0.5 ], [ 0.5, 0, 0.5 ], [ 0.5, 0.5, 0 ], [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ ...

{ "a": 6.5461955070495605, "b": 6.5461955070495605, "c": 6.5461955070495605, "alpha": 90, "beta": 90, "gamma": 90 }

225

SbP3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308178

[ "In", "Pm" ]

[ 61, 61, 61, 61, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49, 49 ]

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225

PmIn3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308189

[ "C", "Np" ]

[ 93, 93, 93, 93, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6, 6 ]

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225

NpC3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308199

[ "Ru", "Hf" ]

[ 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 44, 44, 44, 44 ]

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225

Hf3Ru

general_inorganic

false

null

external_cif_tar

tar:OQMD_308215

[ "Rb", "Th" ]

[ 37, 37, 37, 37, 90, 90, 90, 90, 90, 90, 90, 90, 90, 90, 90, 90 ]

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225

RbTh3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308248

[ "Co", "Ni" ]

[ 27, 27, 27, 27, 27, 27, 27, 27, 27, 27, 27, 27, 28, 28, 28, 28 ]

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225

Co3Ni

general_inorganic

false

null

external_cif_tar

tar:OQMD_308262

[ "Hf", "Np" ]

[ 72, 72, 72, 72, 93, 93, 93, 93, 93, 93, 93, 93, 93, 93, 93, 93 ]

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225

HfNp3

general_inorganic

false

null

external_cif_tar

tar:NOMAD_RLRcSs-r7W71M_JuNYlSlJ2xRFbA

[ "B", "Pa" ]

[ 91, 91, 91, 91, 5, 5, 5, 5, 5, 5, 5, 5, 5, 5, 5, 5 ]

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225

PaB3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308302

[ "Nd", "Re" ]

[ 60, 60, 60, 60, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75, 75 ]

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225

NdRe3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308314

[ "Ni", "I" ]

[ 28, 28, 28, 28, 53, 53, 53, 53, 53, 53, 53, 53, 53, 53, 53, 53 ]

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2

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225

NiI3

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:OQMD_308332

[ "Br", "Y" ]

[ 39, 39, 39, 39, 35, 35, 35, 35, 35, 35, 35, 35, 35, 35, 35, 35 ]

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2

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225

YBr3

general_inorganic

false

null

[ "halide" ]

external_cif_tar

tar:OQMD_308346

[ "Te", "Er" ]

[ 68, 68, 68, 68, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52, 52 ]

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2

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225

ErTe3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308359

[ "Ba", "Tb" ]

[ 56, 56, 56, 56, 65, 65, 65, 65, 65, 65, 65, 65, 65, 65, 65, 65 ]

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225

BaTb3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308374

[ "Ni", "Rb" ]

[ 37, 37, 37, 37, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28, 28 ]

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225

RbNi3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308390

[ "Al", "Fe" ]

[ 13, 13, 13, 13, 13, 13, 13, 13, 13, 13, 13, 13, 26, 26, 26, 26 ]

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2

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225

Al3Fe

general_inorganic

false

null

external_cif_tar

tar:OQMD_308408

[ "Ga", "Rh" ]

[ 31, 31, 31, 31, 45, 45, 45, 45, 45, 45, 45, 45, 45, 45, 45, 45 ]

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2

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225

GaRh3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308426

[ "Be", "Ga" ]

[ 4, 4, 4, 4, 31, 31, 31, 31, 31, 31, 31, 31, 31, 31, 31, 31 ]

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2

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225

BeGa3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308440

[ "Sn", "Ac" ]

[ 89, 89, 89, 89, 89, 89, 89, 89, 89, 89, 89, 89, 50, 50, 50, 50 ]

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225

Ac3Sn

general_inorganic

false

null

external_cif_tar

tar:OQMD_308456

[ "Y", "Hf" ]

[ 39, 39, 39, 39, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72, 72 ]

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225

YHf3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308473

[ "Sr", "Sb" ]

[ 38, 38, 38, 38, 51, 51, 51, 51, 51, 51, 51, 51, 51, 51, 51, 51 ]

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225

SrSb3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308484

[ "Ti", "Se" ]

[ 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 34, 34, 34, 34 ]

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225

Ti3Se

general_inorganic

false

null

external_cif_tar

tar:OQMD_308495

[ "Ta", "Tl" ]

[ 73, 73, 73, 73, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81 ]

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225

TaTl3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308514

[ "Si", "Se" ]

[ 14, 14, 14, 14, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34, 34 ]

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225

SiSe3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308530

[ "Zn", "Tl" ]

[ 81, 81, 81, 81, 30, 30, 30, 30, 30, 30, 30, 30, 30, 30, 30, 30 ]

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225

TlZn3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308551

[ "Ba", "Gd" ]

[ 56, 56, 56, 56, 56, 56, 56, 56, 56, 56, 56, 56, 64, 64, 64, 64 ]

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225

Ba3Gd

general_inorganic

false

null

external_cif_tar

tar:OQMD_308566

[ "C", "Ti" ]

[ 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 22, 6, 6, 6, 6 ]

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225

Ti3C

general_inorganic

false

null

external_cif_tar

tar:OQMD_308579

[ "Rh", "Yb" ]

[ 70, 70, 70, 70, 70, 70, 70, 70, 70, 70, 70, 70, 45, 45, 45, 45 ]

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225

Yb3Rh

general_inorganic

false

null

external_cif_tar

tar:OQMD_308597

[ "O", "Ti" ]

[ 22, 22, 22, 22, 8, 8, 8, 8, 8, 8, 8, 8, 8, 8, 8, 8 ]

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225

TiO3

general_inorganic

false

null

[ "oxide" ]

external_cif_tar

tar:OQMD_308608

[ "Se", "Tm" ]

[ 69, 69, 69, 69, 69, 69, 69, 69, 69, 69, 69, 69, 34, 34, 34, 34 ]

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225

Tm3Se

general_inorganic

false

null

external_cif_tar

tar:OQMD_308627

[ "Rh", "Dy" ]

[ 66, 66, 66, 66, 66, 66, 66, 66, 66, 66, 66, 66, 45, 45, 45, 45 ]

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225

Dy3Rh

general_inorganic

false

null

external_cif_tar

tar:OQMD_308641

[ "Pt", "Tl" ]

[ 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 81, 78, 78, 78, 78 ]

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225

Tl3Pt

general_inorganic

false

null

external_cif_tar

tar:OQMD_308656

[ "Si", "Mo" ]

[ 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 42, 42, 42, 42 ]

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225

Si3Mo

general_inorganic

false

null

external_cif_tar

tar:OQMD_308667

[ "Be", "Si" ]

[ 4, 4, 4, 4, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14, 14 ]

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225

BeSi3

general_inorganic

false

null

external_cif_tar

tar:OQMD_308681

[ "Sc", "Co" ]

[ 21, 21, 21, 21, 21, 21, 21, 21, 21, 21, 21, 21, 27, 27, 27, 27 ]

16

2

[ [ 0.25, 0.75, 0.75 ], [ 0.25, 0.25, 0.75 ], [ 0, 0, 0.5 ], [ 0.25, 0.25, 0.25 ], [ 0.25, 0.75, 0.25 ], [ 0, 0.5, 0 ], [ 0.75, 0.75, 0.25 ], [ 0.75, 0.25, 0.25 ], [ 0.5, 0, 0 ...

{ "a": 6.7125701904296875, "b": 6.7125701904296875, "c": 6.7125701904296875, "alpha": 90, "beta": 90, "gamma": 90 }

225

Sc3Co

general_inorganic

false

null

external_cif_tar