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	hartrees
Energy at 0K	-139.629630
Energy at 298.15K
HF Energy	-139.177224
Nuclear repulsion energy	56.084452

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2492	2492	7.72
2	A₁	2276	2276	311.04
3	A₁	1135	1135	29.41
4	A₁	655	655	22.08
5	E	2570	2570	70.71
5	E	2570	2570	70.71
6	E	1169	1169	0.23
6	E	1169	1169	0.23
7	E	863	863	0.26
7	E	863	863	0.26
8	E	313	313	13.02
8	E	313	313	13.02

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.374
C2	0.000	0.000	0.203
O3	0.000	0.000	1.329
H4	0.000	1.173	-1.660
H5	1.016	-0.586	-1.660
H6	-1.016	-0.586	-1.660

	B1	C2	O3	H4	H5	H6
B1		1.5770	2.7035	1.2070	1.2070	1.2070
C2	1.5770		1.1265	2.2012	2.2012	2.2012
O3	2.7035	1.1265		3.2111	3.2111	3.2111
H4	1.2070	2.2012	3.2111		2.0312	2.0312
H5	1.2070	2.2012	3.2111	2.0312		2.0312
H6	1.2070	2.2012	3.2111	2.0312	2.0312

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.695
C2	B1	H5	103.695	C2	B1	H6	103.695
H4	B1	H5	114.578	H4	B1	H6	114.578
H5	B1	H6	114.578

All results from a given calculation for BH₃CO (Borane carbonyl)

using model chemistry: CCSD/6-311G**

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 BH3CO (Borane carbonyl)

using model chemistry: CCSD/6-311G**

States and conformations

All results from a given calculation for BH₃CO (Borane carbonyl)