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	hartrees
Energy at 0K	-105.088598
Energy at 298.15K
HF Energy	-104.498087
Nuclear repulsion energy	104.550925

Atom	x (Å)	y (Å)	z (Å)
B1	-0.864	0.000	-0.469
B2	0.864	0.000	-0.469
B3	0.000	1.397	0.396
B4	0.000	-1.397	0.396
H5	-1.365	0.000	-1.539
H6	1.365	0.000	-1.539
H7	-1.321	0.915	0.254
H8	-1.321	-0.915	0.254
H9	1.321	-0.915	0.254
H10	1.321	0.915	0.254
H11	0.000	1.403	1.589
H12	0.000	2.428	-0.195
H13	0.000	-1.403	1.589
H14	0.000	-2.428	-0.195

	B1	B2	B3	B4	H5	H6	H7	H8	H9	H10	H11	H12	H13	H14
B1		1.7274	1.8568	1.8568	1.1812	2.4719	1.2527	1.2527	2.4767	2.4767	2.6364	2.5915	2.6364	2.5915
B2	1.7274		1.8568	1.8568	2.4719	1.1812	2.4767	2.4767	1.2527	1.2527	2.6364	2.5915	2.6364	2.5915
B3	1.8568	1.8568		2.7950	2.7494	2.7494	1.4138	2.6671	2.6671	1.4138	1.1928	1.1879	3.0442	3.8708
B4	1.8568	1.8568	2.7950		2.7494	2.7494	2.6671	1.4138	1.4138	2.6671	3.0442	3.8708	1.1928	1.1879
H5	1.1812	2.4719	2.7494	2.7494		2.7296	2.0130	2.0130	3.3564	3.3564	3.6897	3.0925	3.6897	3.0925
H6	2.4719	1.1812	2.7494	2.7494	2.7296		3.3564	3.3564	2.0130	2.0130	3.6897	3.0925	3.6897	3.0925
H7	1.2527	2.4767	1.4138	2.6671	2.0130	3.3564		1.8300	3.2143	2.6426	1.9409	2.0582	2.9837	3.6224
H8	1.2527	2.4767	2.6671	1.4138	2.0130	3.3564	1.8300		2.6426	3.2143	2.9837	3.6224	1.9409	2.0582
H9	2.4767	1.2527	2.6671	1.4138	3.3564	2.0130	3.2143	2.6426		1.8300	2.9837	3.6224	1.9409	2.0582
H10	2.4767	1.2527	1.4138	2.6671	3.3564	2.0130	2.6426	3.2143	1.8300		1.9409	2.0582	2.9837	3.6224
H11	2.6364	2.6364	1.1928	3.0442	3.6897	3.6897	1.9409	2.9837	2.9837	1.9409		2.0571	2.8065	4.2261
H12	2.5915	2.5915	1.1879	3.8708	3.0925	3.0925	2.0582	3.6224	3.6224	2.0582	2.0571		4.2261	4.8558
H13	2.6364	2.6364	3.0442	1.1928	3.6897	3.6897	2.9837	1.9409	1.9409	2.9837	2.8065	4.2261		2.0571
H14	2.5915	2.5915	3.8708	1.1879	3.0925	3.0925	3.6224	2.0582	2.0582	3.6224	4.2261	4.8558	2.0571

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	B2	B3	62.280	B1	B2	B4	62.280
B1	B2	H6	115.104	B1	B2	H9	111.427
B1	B2	H10	111.427	B1	B3	B2	55.440
B1	B3	H7	42.396	B1	B3	H10	97.523
B1	B3	H11	118.010	B1	B3	H12	114.901
B1	B4	B2	55.440	B1	B4	H8	42.396
B1	B4	H9	97.523	B1	B4	H13	118.010
B1	B4	H14	114.901	B1	H7	B3	88.051
B1	H8	B4	88.051	B2	B1	B3	62.280
B2	B1	B4	62.280	B2	B1	H5	115.104
B2	B1	H7	111.427	B2	B1	H8	111.427
B2	B3	H7	97.523	B2	B3	H10	42.396
B2	B3	H11	118.010	B2	B3	H12	114.901
B2	B4	H8	97.523	B2	B4	H9	42.396
B2	B4	H13	118.010	B2	B4	H14	114.901
B2	H9	B4	88.051	B2	H10	B3	88.051
B3	B1	B4	97.640	B3	B1	H5	128.267
B3	B1	H7	49.553	B3	B1	H8	116.792
B3	B2	B4	97.640	B3	B2	H6	128.267
B3	B2	H9	116.792	B3	B2	H10	49.553
B4	B1	H5	128.267	B4	B1	H7	116.792
B4	B1	H8	49.553	B4	B2	H6	128.267
B4	B2	H9	49.553	B4	B2	H10	116.792
H5	B1	H7	111.567	H5	B1	H8	111.567
H6	B2	H9	111.567	H6	B2	H10	111.567
H7	B1	H8	93.845	H7	B3	H10	138.312
H7	B3	H11	95.874	H7	B3	H12	104.238
H8	B4	H9	138.312	H8	B4	H13	95.874
H8	B4	H14	104.238	H9	B2	H10	93.845
H9	B4	H13	95.874	H9	B4	H14	104.238
H10	B3	H11	95.874	H10	B3	H12	104.238
H11	B3	H12	119.559	H13	B4	H14	119.559

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

using model chemistry: CCD/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: CCD/aug-cc-pVTZ

States and conformations

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