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	hartrees
Energy at 0K	-105.019765
Energy at 298.15K	-105.030745
HF Energy	-104.467402
Nuclear repulsion energy	103.431688

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2698	2620
2	A₁	2668	2591
3	A₁	2579	2504
4	A₁	2251	2186
5	A₁	1574	1528
6	A₁	1173	1139
7	A₁	1000	971
8	A₁	857	833
9	A₁	803	780
10	A₁	680	660
11	A₁	564	548
12	A₁	230	224
13	A₂	2276	2211
14	A₂	1478	1435
15	A₂	1071	1040
16	A₂	1023	993
17	A₂	893	867
18	A₂	677	657
19	A₂	399	387
20	B₁	2687	2610
21	B₁	2242	2177
22	B₁	1533	1489
23	B₁	1087	1055
24	B₁	1002	973
25	B₁	906	880
26	B₁	760	738
27	B₁	575	558
28	B₂	2668	2591
29	B₂	2573	2499
30	B₂	2266	2201
31	B₂	1335	1297
32	B₂	1152	1119
33	B₂	930	903
34	B₂	871	846
35	B₂	465	452
36	B₂	343	333

Atom	x (Å)	y (Å)	z (Å)
B1	-0.873	0.000	-0.477
B2	0.873	0.000	-0.477
B3	0.000	1.412	0.403
B4	0.000	-1.412	0.403
H5	-1.381	0.000	-1.557
H6	1.381	0.000	-1.557
H7	-1.333	0.923	0.256
H8	-1.333	-0.923	0.256
H9	1.333	-0.923	0.256
H10	1.333	0.923	0.256
H11	0.000	1.408	1.609
H12	0.000	2.454	-0.195
H13	0.000	-1.408	1.609
H14	0.000	-2.454	-0.195

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7452	1.8789	1.8789	1.1939	2.4989	1.2656	1.2656	2.5009	2.5009	2.6639	2.6201	2.6639	2.6201
B2	1.7452		1.8789	1.8789	2.4989	1.1939	2.5009	2.5009	1.2656	1.2656	2.6639	2.6201	2.6639	2.6201
B3	1.8789	1.8789		2.8240	2.7829	2.7829	1.4274	2.6929	2.6929	1.4274	1.2059	1.2015	3.0670	3.9123
B4	1.8789	1.8789	2.8240		2.7829	2.7829	2.6929	1.4274	1.4274	2.6929	3.0670	3.9123	1.2059	1.2015
H5	1.1939	2.4989	2.7829	2.7829		2.7615	2.0355	2.0355	3.3920	3.3920	3.7305	3.1285	3.7305	3.1285
H6	2.4989	1.1939	2.7829	2.7829	2.7615		3.3920	3.3920	2.0355	2.0355	3.7305	3.1285	3.7305	3.1285
H7	1.2656	2.5009	1.4274	2.6929	2.0355	3.3920		1.8463	3.2429	2.6660	1.9603	2.0795	3.0070	3.6589
H8	1.2656	2.5009	2.6929	1.4274	2.0355	3.3920	1.8463		2.6660	3.2429	3.0070	3.6589	1.9603	2.0795
H9	2.5009	1.2656	2.6929	1.4274	3.3920	2.0355	3.2429	2.6660		1.8463	3.0070	3.6589	1.9603	2.0795
H10	2.5009	1.2656	1.4274	2.6929	3.3920	2.0355	2.6660	3.2429	1.8463		1.9603	2.0795	3.0070	3.6589
H11	2.6639	2.6639	1.2059	3.0670	3.7305	3.7305	1.9603	3.0070	3.0070	1.9603		2.0852	2.8160	4.2627
H12	2.6201	2.6201	1.2015	3.9123	3.1285	3.1285	2.0795	3.6589	3.6589	2.0795	2.0852		4.2627	4.9086
H13	2.6639	2.6639	3.0670	1.2059	3.7305	3.7305	3.0070	1.9603	1.9603	3.0070	2.8160	4.2627		2.0852
H14	2.6201	2.6201	3.9123	1.2015	3.1285	3.1285	3.6589	2.0795	2.0795	3.6589	4.2627	4.9086	2.0852

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.327	B1	B2	B4	62.327
B1	B2	H6	115.190	B1	B2	H9	111.333
B1	B2	H10	111.333	B1	B3	B2	55.345
B1	B3	H7	42.321	B1	B3	H10	97.355
B1	B3	H11	117.778	B1	B3	H12	114.758
B1	B4	B2	55.345	B1	B4	H8	42.321
B1	B4	H9	97.355	B1	B4	H13	117.778
B1	B4	H14	114.758	B1	H7	B3	88.271
B1	H8	B4	88.271	B2	B1	B3	62.327
B2	B1	B4	62.327	B2	B1	H5	115.190
B2	B1	H7	111.333	B2	B1	H8	111.333
B2	B3	H7	97.355	B2	B3	H10	42.321
B2	B3	H11	117.778	B2	B3	H12	114.758
B2	B4	H8	97.355	B2	B4	H9	42.321
B2	B4	H13	117.778	B2	B4	H14	114.758
B2	H9	B4	88.271	B2	H10	B3	88.271
B3	B1	B4	97.443	B3	B1	H5	128.438
B3	B1	H7	49.408	B3	B1	H8	116.466
B3	B2	B4	97.443	B3	B2	H6	128.438
B3	B2	H9	116.466	B3	B2	H10	49.408
B4	B1	H5	128.438	B4	B1	H7	116.466
B4	B1	H8	49.408	B4	B2	H6	128.438
B4	B2	H9	49.408	B4	B2	H10	116.466
H5	B1	H7	111.678	H5	B1	H8	111.678
H6	B2	H9	111.678	H6	B2	H10	111.678
H7	B1	H8	93.675	H7	B3	H10	138.087
H7	B3	H11	95.852	H7	B3	H12	104.228
H8	B4	H9	138.087	H8	B4	H13	95.852
H8	B4	H14	104.228	H9	B2	H10	93.675
H9	B4	H13	95.852	H9	B4	H14	104.228
H10	B3	H11	95.852	H10	B3	H12	104.228
H11	B3	H12	120.027	H13	B4	H14	120.027

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

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

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-pVDZ

States and conformations

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