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	hartrees
Energy at 0K	-105.197042
Energy at 298.15K
HF Energy	-104.497474
Nuclear repulsion energy	104.937532

Atom	x (Å)	y (Å)	z (Å)
B1	-0.861	0.000	-0.469
B2	0.861	0.000	-0.469
B3	0.000	1.388	0.394
B4	0.000	-1.388	0.394
H5	-1.358	0.000	-1.538
H6	1.358	0.000	-1.538
H7	-1.320	0.913	0.255
H8	-1.320	-0.913	0.255
H9	1.320	-0.913	0.255
H10	1.320	0.913	0.255
H11	0.000	1.386	1.585
H12	0.000	2.422	-0.185
H13	0.000	-1.386	1.585
H14	0.000	-2.422	-0.185

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7218	1.8469	1.8469	1.1793	2.4634	1.2520	1.2520	2.4723	2.4723	2.6228	2.5859	2.6228	2.5859
B2	1.7218		1.8469	1.8469	2.4634	1.1793	2.4723	2.4723	1.2520	1.2520	2.6228	2.5859	2.6228	2.5859
B3	1.8469	1.8469		2.7751	2.7393	2.7393	1.4094	2.6557	2.6557	1.4094	1.1908	1.1855	3.0181	3.8532
B4	1.8469	1.8469	2.7751		2.7393	2.7393	2.6557	1.4094	1.4094	2.6557	3.0181	3.8532	1.1908	1.1855
H5	1.1793	2.4634	2.7393	2.7393		2.7167	2.0123	2.0123	3.3497	3.3497	3.6767	3.0888	3.6767	3.0888
H6	2.4634	1.1793	2.7393	2.7393	2.7167		3.3497	3.3497	2.0123	2.0123	3.6767	3.0888	3.6767	3.0888
H7	1.2520	2.4723	1.4094	2.6557	2.0123	3.3497		1.8256	3.2093	2.6395	1.9324	2.0525	2.9654	3.6132
H8	1.2520	2.4723	2.6557	1.4094	2.0123	3.3497	1.8256		2.6395	3.2093	2.9654	3.6132	1.9324	2.0525
H9	2.4723	1.2520	2.6557	1.4094	3.3497	2.0123	3.2093	2.6395		1.8256	2.9654	3.6132	1.9324	2.0525
H10	2.4723	1.2520	1.4094	2.6557	3.3497	2.0123	2.6395	3.2093	1.8256		1.9324	2.0525	2.9654	3.6132
H11	2.6228	2.6228	1.1908	3.0181	3.6767	3.6767	1.9324	2.9654	2.9654	1.9324		2.0511	2.7714	4.1989
H12	2.5859	2.5859	1.1855	3.8532	3.0888	3.0888	2.0525	3.6132	3.6132	2.0525	2.0511		4.1989	4.8437
H13	2.6228	2.6228	3.0181	1.1908	3.6767	3.6767	2.9654	1.9324	1.9324	2.9654	2.7714	4.1989		2.0511
H14	2.5859	2.5859	3.8532	1.1855	3.0888	3.0888	3.6132	2.0525	2.0525	3.6132	4.1989	4.8437	2.0511

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.217	B1	B2	B4	62.217
B1	B2	H6	114.951	B1	B2	H9	111.500
B1	B2	H10	111.500	B1	B3	B2	55.565
B1	B3	H7	42.636	B1	B3	H10	97.889
B1	B3	H11	117.779	B1	B3	H12	115.286
B1	B4	B2	55.565	B1	B4	H8	42.636
B1	B4	H9	97.889	B1	B4	H13	117.779
B1	B4	H14	115.286	B1	H7	B3	87.678
B1	H8	B4	87.678	B2	B1	B3	62.217
B2	B1	B4	62.217	B2	B1	H5	114.951
B2	B1	H7	111.500	B2	B1	H8	111.500
B2	B3	H7	97.889	B2	B3	H10	42.636
B2	B3	H11	117.779	B2	B3	H12	115.286
B2	B4	H8	97.889	B2	B4	H9	42.636
B2	B4	H13	117.779	B2	B4	H14	115.286
B2	H9	B4	87.678	B2	H10	B3	87.678
B3	B1	B4	97.402	B3	B1	H5	128.335
B3	B1	H7	49.686	B3	B1	H8	116.646
B3	B2	B4	97.402	B3	B2	H6	128.335
B3	B2	H9	116.646	B3	B2	H10	49.686
B4	B1	H5	128.335	B4	B1	H7	116.646
B4	B1	H8	49.686	B4	B2	H6	128.335
B4	B2	H9	49.686	B4	B2	H10	116.646
H5	B1	H7	111.684	H5	B1	H8	111.684
H6	B2	H9	111.684	H6	B2	H10	111.684
H7	B1	H8	93.615	H7	B3	H10	138.900
H7	B3	H11	95.639	H7	B3	H12	104.218
H8	B4	H9	138.900	H8	B4	H13	95.639
H8	B4	H14	104.218	H9	B2	H10	93.615
H9	B4	H13	95.639	H9	B4	H14	104.218
H10	B3	H11	95.639	H10	B3	H12	104.218
H11	B3	H12	119.343	H13	B4	H14	119.343

All results from a given calculation for B₄H₁₀ (Tetraborane(10))

using model chemistry: CCSD(T)=FULL/aug-cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for B4H10 (Tetraborane(10))

using model chemistry: CCSD(T)=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for B₄H₁₀ (Tetraborane(10))