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	hartrees
Energy at 0K	-105.070186
Energy at 298.15K	-105.081379
HF Energy	-104.476120
Nuclear repulsion energy	105.058105

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2764	2602	73.87
2	A₁	2747	2587	23.83
3	A₁	2658	2503	36.37
4	A₁	2304	2169	12.21
5	A₁	1611	1517	9.96
6	A₁	1209	1139	10.74
7	A₁	1041	980	3.60
8	A₁	881	829	0.00
9	A₁	826	778	1.07
10	A₁	696	655	0.00
11	A₁	596	561	0.10
12	A₁	251	237	7.71
13	A₂	2335	2198	0.00
14	A₂	1513	1425	0.00
15	A₂	1124	1059	0.00
16	A₂	1065	1003	0.00
17	A₂	942	887	0.00
18	A₂	706	664	0.00
19	A₂	411	387	0.00
20	B₁	2755	2594	24.22
21	B₁	2303	2168	18.32
22	B₁	1568	1476	49.03
23	B₁	1137	1071	10.54
24	B₁	1059	997	66.28
25	B₁	947	892	15.72
26	B₁	777	731	1.24
27	B₁	599	564	20.44
28	B₂	2748	2588	56.89
29	B₂	2654	2499	73.56
30	B₂	2324	2188	113.30
31	B₂	1363	1283	2.41
32	B₂	1192	1122	41.34
33	B₂	963	907	15.96
34	B₂	898	846	29.98
35	B₂	505	476	10.09
36	B₂	357	336	3.41

Atom	x (Å)	y (Å)	z (Å)
B1	-0.859	0.000	-0.469
B2	0.859	0.000	-0.469
B3	0.000	1.384	0.395
B4	0.000	-1.384	0.395
H5	-1.361	0.000	-1.537
H6	1.361	0.000	-1.537
H7	-1.321	0.907	0.258
H8	-1.321	-0.907	0.258
H9	1.321	-0.907	0.258
H10	1.321	0.907	0.258
H11	0.000	1.385	1.586
H12	0.000	2.416	-0.192
H13	0.000	-1.385	1.586
H14	0.000	-2.416	-0.192

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7174	1.8434	1.8434	1.1799	2.4629	1.2508	1.2508	2.4700	2.4700	2.6226	2.5787	2.6226	2.5787
B2	1.7174		1.8434	1.8434	2.4629	1.1799	2.4700	2.4700	1.2508	1.2508	2.6226	2.5787	2.6226	2.5787
B3	1.8434	1.8434		2.7673	2.7382	2.7382	1.4109	2.6477	2.6477	1.4109	1.1910	1.1870	3.0139	3.8443
B4	1.8434	1.8434	2.7673		2.7382	2.7382	2.6477	1.4109	1.4109	2.6477	3.0139	3.8443	1.1910	1.1870
H5	1.1799	2.4629	2.7382	2.7382		2.7213	2.0112	2.0112	3.3517	3.3517	3.6771	3.0816	3.6771	3.0816
H6	2.4629	1.1799	2.7382	2.7382	2.7213		3.3517	3.3517	2.0112	2.0112	3.6771	3.0816	3.6771	3.0816
H7	1.2508	2.4700	1.4109	2.6477	2.0112	3.3517		1.8139	3.2044	2.6416	1.9331	2.0549	2.9599	3.6036
H8	1.2508	2.4700	2.6477	1.4109	2.0112	3.3517	1.8139		2.6416	3.2044	2.9599	3.6036	1.9331	2.0549
H9	2.4700	1.2508	2.6477	1.4109	3.3517	2.0112	3.2044	2.6416		1.8139	2.9599	3.6036	1.9331	2.0549
H10	2.4700	1.2508	1.4109	2.6477	3.3517	2.0112	2.6416	3.2044	1.8139		1.9331	2.0549	2.9599	3.6036
H11	2.6226	2.6226	1.1910	3.0139	3.6771	3.6771	1.9331	2.9599	2.9599	1.9331		2.0547	2.7698	4.1956
H12	2.5787	2.5787	1.1870	3.8443	3.0816	3.0816	2.0549	3.6036	3.6036	2.0549	2.0547		4.1956	4.8312
H13	2.6226	2.6226	3.0139	1.1910	3.6771	3.6771	2.9599	1.9331	1.9331	2.9599	2.7698	4.1956		2.0547
H14	2.5787	2.5787	3.8443	1.1870	3.0816	3.0816	3.6036	2.0549	2.0549	3.6036	4.1956	4.8312	2.0547

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.238	B1	B2	B4	62.238
B1	B2	H6	115.179	B1	B2	H9	111.682
B1	B2	H10	111.682	B1	B3	B2	55.525
B1	B3	H7	42.675	B1	B3	H10	97.871
B1	B3	H11	117.999	B1	B3	H12	114.897
B1	B4	B2	55.525	B1	B4	H8	42.675
B1	B4	H9	97.871	B1	B4	H13	117.999
B1	B4	H14	114.897	B1	H7	B3	87.454
B1	H8	B4	87.454	B2	B1	B3	62.238
B2	B1	B4	62.238	B2	B1	H5	115.179
B2	B1	H7	111.682	B2	B1	H8	111.682
B2	B3	H7	97.871	B2	B3	H10	42.675
B2	B3	H11	117.999	B2	B3	H12	114.897
B2	B4	H8	97.871	B2	B4	H9	42.675
B2	B4	H13	117.999	B2	B4	H14	114.897
B2	H9	B4	87.454	B2	H10	B3	87.454
B3	B1	B4	97.282	B3	B1	H5	128.485
B3	B1	H7	49.870	B3	B1	H8	116.359
B3	B2	B4	97.282	B3	B2	H6	128.485
B3	B2	H9	116.359	B3	B2	H10	49.870
B4	B1	H5	128.485	B4	B1	H7	116.359
B4	B1	H8	49.870	B4	B2	H6	128.485
B4	B2	H9	49.870	B4	B2	H10	116.359
H5	B1	H7	111.638	H5	B1	H8	111.638
H6	B2	H9	111.638	H6	B2	H10	111.638
H7	B1	H8	92.956	H7	B3	H10	138.835
H7	B3	H11	95.596	H7	B3	H12	104.226
H8	B4	H9	138.835	H8	B4	H13	95.596
H8	B4	H14	104.226	H9	B2	H10	92.956
H9	B4	H13	95.596	H9	B4	H14	104.226
H10	B3	H11	95.596	H10	B3	H12	104.226
H11	B3	H12	119.550	H13	B4	H14	119.550

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

using model chemistry: CCSD=FULL/6-31G(2df,p)

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=FULL/6-31G(2df,p)

States and conformations

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