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	hartrees
Energy at 0K	-105.022153
Energy at 298.15K	-105.033265
HF Energy	-104.492902
Nuclear repulsion energy	104.358608

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2734	2612	99.99
2	A₁	2714	2592	34.92
3	A₁	2623	2506	47.77
4	A₁	2290	2187	20.02
5	A₁	1607	1535	11.13
6	A₁	1205	1151	13.50
7	A₁	1050	1003	1.97
8	A₁	877	837	0.44
9	A₁	817	780	0.97
10	A₁	700	669	0.12
11	A₁	567	542	0.00
12	A₁	236	225	6.94
13	A₂	2319	2215	0.00
14	A₂	1512	1444	0.00
15	A₂	1119	1069	0.00
16	A₂	1051	1004	0.00
17	A₂	930	888	0.00
18	A₂	685	654	0.00
19	A₂	419	401	0.00
20	B₁	2724	2603	32.41
21	B₁	2284	2182	16.79
22	B₁	1572	1501	59.02
23	B₁	1139	1088	10.69
24	B₁	1037	991	66.48
25	B₁	936	894	14.77
26	B₁	786	751	0.28
27	B₁	585	559	22.39
28	B₂	2714	2593	74.65
29	B₂	2619	2502	80.66
30	B₂	2310	2207	140.54
31	B₂	1364	1303	2.66
32	B₂	1186	1133	50.65
33	B₂	972	929	19.27
34	B₂	895	855	42.36
35	B₂	453	432	13.87
36	B₂	356	340	1.55

Atom	x (Å)	y (Å)	z (Å)
B1	-0.863	0.000	-0.471
B2	0.863	0.000	-0.471
B3	0.000	1.403	0.400
B4	0.000	-1.403	0.400
H5	-1.366	0.000	-1.541
H6	1.366	0.000	-1.541
H7	-1.320	0.919	0.248
H8	-1.320	-0.919	0.248
H9	1.320	-0.919	0.248
H10	1.320	0.919	0.248
H11	0.000	1.407	1.593
H12	0.000	2.433	-0.193
H13	0.000	-1.407	1.593
H14	0.000	-2.433	-0.193

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7261	1.8632	1.8632	1.1826	2.4727	1.2531	1.2531	2.4756	2.4756	2.6428	2.5969	2.6428	2.5969
B2	1.7261		1.8632	1.8632	2.4727	1.1826	2.4756	2.4756	1.2531	1.2531	2.6428	2.5969	2.6428	2.5969
B3	1.8632	1.8632		2.8062	2.7572	2.7572	1.4146	2.6754	2.6754	1.4146	1.1933	1.1888	3.0529	3.8821
B4	1.8632	1.8632	2.8062		2.7572	2.7572	2.6754	1.4146	1.4146	2.6754	3.0529	3.8821	1.1933	1.1888
H5	1.1826	2.4727	2.7572	2.7572		2.7321	2.0118	2.0118	3.3559	3.3559	3.6972	3.0992	3.6972	3.0992
H6	2.4727	1.1826	2.7572	2.7572	2.7321		3.3559	3.3559	2.0118	2.0118	3.6972	3.0992	3.6972	3.0992
H7	1.2531	2.4756	1.4146	2.6754	2.0118	3.3559		1.8376	3.2173	2.6408	1.9470	2.0573	2.9937	3.6299
H8	1.2531	2.4756	2.6754	1.4146	2.0118	3.3559	1.8376		2.6408	3.2173	2.9937	3.6299	1.9470	2.0573
H9	2.4756	1.2531	2.6754	1.4146	3.3559	2.0118	3.2173	2.6408		1.8376	2.9937	3.6299	1.9470	2.0573
H10	2.4756	1.2531	1.4146	2.6754	3.3559	2.0118	2.6408	3.2173	1.8376		1.9470	2.0573	2.9937	3.6299
H11	2.6428	2.6428	1.1933	3.0529	3.6972	3.6972	1.9470	2.9937	2.9937	1.9470		2.0602	2.8139	4.2355
H12	2.5969	2.5969	1.1888	3.8821	3.0992	3.0992	2.0573	3.6299	3.6299	2.0573	2.0602		4.2355	4.8670
H13	2.6428	2.6428	3.0529	1.1933	3.6972	3.6972	2.9937	1.9470	1.9470	2.9937	2.8139	4.2355		2.0602
H14	2.5969	2.5969	3.8821	1.1888	3.0992	3.0992	3.6299	2.0573	2.0573	3.6299	4.2355	4.8670	2.0602

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.406	B1	B2	B4	62.406
B1	B2	H6	115.170	B1	B2	H9	111.406
B1	B2	H10	111.406	B1	B3	B2	55.188
B1	B3	H7	42.241	B1	B3	H10	97.147
B1	B3	H11	118.016	B1	B3	H12	114.809
B1	B4	B2	55.188	B1	B4	H8	42.241
B1	B4	H9	97.147	B1	B4	H13	118.016
B1	B4	H14	114.809	B1	H7	B3	88.391
B1	H8	B4	88.391	B2	B1	B3	62.406
B2	B1	B4	62.406	B2	B1	H5	115.170
B2	B1	H7	111.406	B2	B1	H8	111.406
B2	B3	H7	97.147	B2	B3	H10	42.241
B2	B3	H11	118.016	B2	B3	H12	114.809
B2	B4	H8	97.147	B2	B4	H9	42.241
B2	B4	H13	118.016	B2	B4	H14	114.809
B2	H9	B4	88.391	B2	H10	B3	88.391
B3	B1	B4	97.710	B3	B1	H5	128.311
B3	B1	H7	49.368	B3	B1	H8	116.947
B3	B2	B4	97.710	B3	B2	H6	128.311
B3	B2	H9	116.947	B3	B2	H10	49.368
B4	B1	H5	128.311	B4	B1	H7	116.947
B4	B1	H8	49.368	B4	B2	H6	128.311
B4	B2	H9	49.368	B4	B2	H10	116.947
H5	B1	H7	111.345	H5	B1	H8	111.345
H6	B2	H9	111.345	H6	B2	H10	111.345
H7	B1	H8	94.322	H7	B3	H10	137.950
H7	B3	H11	96.225	H7	B3	H12	104.075
H8	B4	H9	137.950	H8	B4	H13	96.225
H8	B4	H14	104.075	H9	B2	H10	94.322
H9	B4	H13	96.225	H9	B4	H14	104.075
H10	B3	H11	96.225	H10	B3	H12	104.075
H11	B3	H12	119.736	H13	B4	H14	119.736

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

using model chemistry: QCISD/TZVP

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: QCISD/TZVP

States and conformations

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