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	hartrees
Energy at 0K	-105.116211
Energy at 298.15K
HF Energy	-104.497918
Nuclear repulsion energy	104.459943

Atom	x (Å)	y (Å)	z (Å)
B1	-0.865	0.000	-0.471
B2	0.865	0.000	-0.471
B3	0.000	1.395	0.398
B4	0.000	-1.395	0.398
H5	-1.364	0.000	-1.544
H6	1.364	0.000	-1.544
H7	-1.325	0.916	0.255
H8	-1.325	-0.916	0.255
H9	1.325	-0.916	0.255
H10	1.325	0.916	0.255
H11	0.000	1.392	1.592
H12	0.000	2.430	-0.189
H13	0.000	-1.392	1.592
H14	0.000	-2.430	-0.189

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7302	1.8575	1.8575	1.1829	2.4738	1.2561	1.2561	2.4822	2.4822	2.6351	2.5951	2.6351	2.5951
B2	1.7302		1.8575	1.8575	2.4738	1.1829	2.4822	2.4822	1.2561	1.2561	2.6351	2.5951	2.6351	2.5951
B3	1.8575	1.8575		2.7906	2.7526	2.7526	1.4157	2.6679	2.6679	1.4157	1.1949	1.1895	3.0322	3.8702
B4	1.8575	1.8575	2.7906		2.7526	2.7526	2.6679	1.4157	1.4157	2.6679	3.0322	3.8702	1.1949	1.1895
H5	1.1829	2.4738	2.7526	2.7526		2.7282	2.0190	2.0190	3.3621	3.3621	3.6924	3.0989	3.6924	3.0989
H6	2.4738	1.1829	2.7526	2.7526	2.7282		3.3621	3.3621	2.0190	2.0190	3.6924	3.0989	3.6924	3.0989
H7	1.2561	2.4822	1.4157	2.6679	2.0190	3.3621		1.8325	3.2211	2.6491	1.9415	2.0600	2.9782	3.6263
H8	1.2561	2.4822	2.6679	1.4157	2.0190	3.3621	1.8325		2.6491	3.2211	2.9782	3.6263	1.9415	2.0600
H9	2.4822	1.2561	2.6679	1.4157	3.3621	2.0190	3.2211	2.6491		1.8325	2.9782	3.6263	1.9415	2.0600
H10	2.4822	1.2561	1.4157	2.6679	3.3621	2.0190	2.6491	3.2211	1.8325		1.9415	2.0600	2.9782	3.6263
H11	2.6351	2.6351	1.1949	3.0322	3.6924	3.6924	1.9415	2.9782	2.9782	1.9415		2.0620	2.7831	4.2165
H12	2.5951	2.5951	1.1895	3.8702	3.0989	3.0989	2.0600	3.6263	3.6263	2.0600	2.0620		4.2165	4.8605
H13	2.6351	2.6351	3.0322	1.1949	3.6924	3.6924	2.9782	1.9415	1.9415	2.9782	2.7831	4.2165		2.0620
H14	2.5951	2.5951	3.8702	1.1895	3.0989	3.0989	3.6263	2.0600	2.0600	3.6263	4.2165	4.8605	2.0620

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.242	B1	B2	B4	62.242
B1	B2	H6	114.950	B1	B2	H9	111.454
B1	B2	H10	111.454	B1	B3	B2	55.517
B1	B3	H7	42.516	B1	B3	H10	97.724
B1	B3	H11	117.738	B1	B3	H12	115.023
B1	B4	B2	55.517	B1	B4	H8	42.516
B1	B4	H9	97.724	B1	B4	H13	117.738
B1	B4	H14	115.023	B1	H7	B3	87.873
B1	H8	B4	87.873	B2	B1	B3	62.242
B2	B1	B4	62.242	B2	B1	H5	114.950
B2	B1	H7	111.454	B2	B1	H8	111.454
B2	B3	H7	97.724	B2	B3	H10	42.516
B2	B3	H11	117.738	B2	B3	H12	115.023
B2	B4	H8	97.724	B2	B4	H9	42.516
B2	B4	H13	117.738	B2	B4	H14	115.023
B2	H9	B4	87.873	B2	H10	B3	87.873
B3	B1	B4	97.385	B3	B1	H5	128.359
B3	B1	H7	49.611	B3	B1	H8	116.606
B3	B2	B4	97.385	B3	B2	H6	128.359
B3	B2	H9	116.606	B3	B2	H10	49.611
B4	B1	H5	128.359	B4	B1	H7	116.606
B4	B1	H8	49.611	B4	B2	H6	128.359
B4	B2	H9	49.611	B4	B2	H10	116.606
H5	B1	H7	111.706	H5	B1	H8	111.706
H6	B2	H9	111.706	H6	B2	H10	111.706
H7	B1	H8	93.674	H7	B3	H10	138.649
H7	B3	H11	95.725	H7	B3	H12	104.165
H8	B4	H9	138.649	H8	B4	H13	95.725
H8	B4	H14	104.165	H9	B2	H10	93.674
H9	B4	H13	95.725	H9	B4	H14	104.165
H10	B3	H11	95.725	H10	B3	H12	104.165
H11	B3	H12	119.713	H13	B4	H14	119.713

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

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

States and conformations

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