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	hartrees
Energy at 0K	-105.298305
Energy at 298.15K	-105.309405
HF Energy	-105.098737
Nuclear repulsion energy	104.886837

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2723	2612	87.19
2	A₁	2698	2589	36.82
3	A₁	2610	2504	50.65
4	A₁	2251	2160	12.91
5	A₁	1593	1528	7.73
6	A₁	1195	1146	10.02
7	A₁	1010	969	4.31
8	A₁	862	827	0.00
9	A₁	809	776	1.08
10	A₁	684	656	0.02
11	A₁	575	551	0.05
12	A₁	220	211	7.56
13	A₂	2284	2191	0.00
14	A₂	1489	1429	0.00
15	A₂	1091	1047	0.00
16	A₂	1043	1001	0.00
17	A₂	925	887	0.00
18	A₂	689	661	0.00
19	A₂	420	403	0.00
20	B₁	2714	2604	31.92
21	B₁	2257	2166	13.08
22	B₁	1547	1485	39.73
23	B₁	1108	1063	16.98
24	B₁	1019	978	54.39
25	B₁	927	889	13.95
26	B₁	767	736	1.02
27	B₁	581	557	17.74
28	B₂	2700	2590	78.47
29	B₂	2606	2500	75.91
30	B₂	2268	2176	115.86
31	B₂	1348	1294	5.05
32	B₂	1178	1130	38.62
33	B₂	949	910	21.31
34	B₂	892	856	29.24
35	B₂	498	478	10.52
36	B₂	364	349	2.44

Atom	x (Å)	y (Å)	z (Å)
B1	-0.859	0.000	-0.463
B2	0.859	0.000	-0.463
B3	0.000	1.399	0.389
B4	0.000	-1.399	0.389
H5	-1.363	0.000	-1.527
H6	1.363	0.000	-1.527
H7	-1.315	0.913	0.261
H8	-1.315	-0.913	0.261
H9	1.315	-0.913	0.261
H10	1.315	0.913	0.261
H11	0.000	1.423	1.578
H12	0.000	2.422	-0.206
H13	0.000	-1.423	1.578
H14	0.000	-2.422	-0.206

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7170	1.8492	1.8492	1.1777	2.4629	1.2514	1.2514	2.4660	2.4660	2.6317	2.5821	2.6317	2.5821
B2	1.7170		1.8492	1.8492	2.4629	1.1777	2.4660	2.4660	1.2514	1.2514	2.6317	2.5821	2.6317	2.5821
B3	1.8492	1.8492		2.7972	2.7361	2.7361	1.4075	2.6625	2.6625	1.4075	1.1886	1.1834	3.0615	3.8662
B4	1.8492	1.8492	2.7972		2.7361	2.7361	2.6625	1.4075	1.4075	2.6625	3.0615	3.8662	1.1886	1.1834
H5	1.1777	2.4629	2.7361	2.7361		2.7251	2.0085	2.0085	3.3467	3.3467	3.6772	3.0769	3.6772	3.0769
H6	2.4629	1.1777	2.7361	2.7361	2.7251		3.3467	3.3467	2.0085	2.0085	3.6772	3.0769	3.6772	3.0769
H7	1.2514	2.4660	1.4075	2.6625	2.0085	3.3467		1.8260	3.2016	2.6297	1.9293	2.0548	2.9864	3.6147
H8	1.2514	2.4660	2.6625	1.4075	2.0085	3.3467	1.8260		2.6297	3.2016	2.9864	3.6147	1.9293	2.0548
H9	2.4660	1.2514	2.6625	1.4075	3.3467	2.0085	3.2016	2.6297		1.8260	2.9864	3.6147	1.9293	2.0548
H10	2.4660	1.2514	1.4075	2.6625	3.3467	2.0085	2.6297	3.2016	1.8260		1.9293	2.0548	2.9864	3.6147
H11	2.6317	2.6317	1.1886	3.0615	3.6772	3.6772	1.9293	2.9864	2.9864	1.9293		2.0440	2.8456	4.2379
H12	2.5821	2.5821	1.1834	3.8662	3.0769	3.0769	2.0548	3.6147	3.6147	2.0548	2.0440		4.2379	4.8431
H13	2.6317	2.6317	3.0615	1.1886	3.6772	3.6772	2.9864	1.9293	1.9293	2.9864	2.8456	4.2379		2.0440
H14	2.5821	2.5821	3.8662	1.1834	3.0769	3.0769	3.6147	2.0548	2.0548	3.6147	4.2379	4.8431	2.0440

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.338	B1	B2	B4	62.338
B1	B2	H6	115.342	B1	B2	H9	111.387
B1	B2	H10	111.387	B1	B3	B2	55.325
B1	B3	H7	42.555	B1	B3	H10	97.514
B1	B3	H11	118.437	B1	B3	H12	114.964
B1	B4	B2	55.325	B1	B4	H8	42.555
B1	B4	H9	97.514	B1	B4	H13	118.437
B1	B4	H14	114.964	B1	H7	B3	87.923
B1	H8	B4	87.923	B2	B1	B3	62.338
B2	B1	B4	62.338	B2	B1	H5	115.342
B2	B1	H7	111.387	B2	B1	H8	111.387
B2	B3	H7	97.514	B2	B3	H10	42.555
B2	B3	H11	118.437	B2	B3	H12	114.964
B2	B4	H8	97.514	B2	B4	H9	42.555
B2	B4	H13	118.437	B2	B4	H14	114.964
B2	H9	B4	87.923	B2	H10	B3	87.923
B3	B1	B4	98.285	B3	B1	H5	127.970
B3	B1	H7	49.522	B3	B1	H8	117.031
B3	B2	B4	98.285	B3	B2	H6	127.970
B3	B2	H9	117.031	B3	B2	H10	49.522
B4	B1	H5	127.970	B4	B1	H7	117.031
B4	B1	H8	49.522	B4	B2	H6	127.970
B4	B2	H9	49.522	B4	B2	H10	117.031
H5	B1	H7	111.518	H5	B1	H8	111.518
H6	B2	H9	111.518	H6	B2	H10	111.518
H7	B1	H8	93.703	H7	B3	H10	138.188
H7	B3	H11	95.631	H7	B3	H12	104.620
H8	B4	H9	138.188	H8	B4	H13	95.631
H8	B4	H14	104.620	H9	B2	H10	93.703
H9	B4	H13	95.631	H9	B4	H14	104.620
H10	B3	H11	95.631	H10	B3	H12	104.620
H11	B3	H12	119.019	H13	B4	H14	119.019

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

using model chemistry: B2PLYP=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: B2PLYP=FULL/aug-cc-pVTZ

States and conformations

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