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	hartrees
Energy at 0K	-139.566501
Energy at 298.15K	-139.568771
HF Energy	-139.152234
Nuclear repulsion energy	55.731391

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2510	2399	5.96
2	A₁	2165	2069	237.97
3	A₁	1113	1063	18.64
4	A₁	694	664	29.98
5	E	2604	2489	59.60
5	E	2604	2489	59.60
6	E	1150	1099	0.01
6	E	1150	1099	0.01
7	E	837	801	0.73
7	E	837	801	0.73
8	E	303	290	8.86
8	E	303	290	8.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.373
C2	0.000	0.000	0.193
O3	0.000	0.000	1.337
H4	0.000	1.181	-1.663
H5	1.023	-0.591	-1.663
H6	-1.023	-0.591	-1.663

	B1	C2	O3	H4	H5	H6
B1		1.5661	2.7096	1.2163	1.2163	1.2163
C2	1.5661		1.1436	2.2002	2.2002	2.2002
O3	2.7096	1.1436		3.2240	3.2240	3.2240
H4	1.2163	2.2002	3.2240		2.0458	2.0458
H5	1.2163	2.2002	3.2240	2.0458		2.0458
H6	1.2163	2.2002	3.2240	2.0458	2.0458

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.804
C2	B1	H5	103.804	C2	B1	H6	103.804
H4	B1	H5	114.495	H4	B1	H6	114.495
H5	B1	H6	114.495

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

using model chemistry: MP2/cc-pCVDZ

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: MP2/cc-pCVDZ

States and conformations

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