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	hartrees
Energy at 0K	-139.708764
Energy at 298.15K
HF Energy	-139.193660
Nuclear repulsion energy	56.323479

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2490	2344	5.34
2	A₁	2267	2134	339.59
3	A₁	1128	1061	25.73
4	A₁	673	633	26.20
5	E	2569	2418	64.43
5	E	2569	2418	64.43
6	E	1162	1094	0.28
6	E	1162	1094	0.28
7	E	855	805	1.16
7	E	855	805	1.16
8	E	310	292	10.31
8	E	310	292	10.31

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.364
C2	0.000	0.000	0.198
O3	0.000	0.000	1.323
H4	0.000	1.170	-1.650
H5	1.013	-0.585	-1.650
H6	-1.013	-0.585	-1.650

	B1	C2	O3	H4	H5	H6
B1		1.5616	2.6869	1.2041	1.2041	1.2041
C2	1.5616		1.1253	2.1864	2.1864	2.1864
O3	2.6869	1.1253		3.1944	3.1944	3.1944
H4	1.2041	2.1864	3.1944		2.0261	2.0261
H5	1.2041	2.1864	3.1944	2.0261		2.0261
H6	1.2041	2.1864	3.1944	2.0261	2.0261

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.721
C2	B1	H5	103.721	C2	B1	H6	103.721
H4	B1	H5	114.558	H4	B1	H6	114.558
H5	B1	H6	114.558

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

using model chemistry: CCSD/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 BH3CO (Borane carbonyl)

using model chemistry: CCSD/cc-pVTZ

States and conformations

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