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	hartrees
Energy at 0K	-139.698446
Energy at 298.15K	-139.700729
HF Energy	-139.192608
Nuclear repulsion energy	56.305847

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2516	2399	3.02
2	A₁	2165	2063	270.73
3	A₁	1118	1066	15.87
4	A₁	712	679	37.21
5	E	2602	2480	50.89
5	E	2602	2480	50.89
6	E	1159	1105	0.07
6	E	1159	1105	0.07
7	E	838	799	1.74
7	E	838	799	1.74
8	E	307	292	7.15
8	E	307	292	7.15

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.356
C2	0.000	0.000	0.188
O3	0.000	0.000	1.324
H4	0.000	1.166	-1.645
H5	1.010	-0.583	-1.645
H6	-1.010	-0.583	-1.645

	B1	C2	O3	H4	H5	H6
B1		1.5433	2.6792	1.2018	1.2018	1.2018
C2	1.5433		1.1359	2.1724	2.1724	2.1724
O3	2.6792	1.1359		3.1896	3.1896	3.1896
H4	1.2018	2.1724	3.1896		2.0203	2.0203
H5	1.2018	2.1724	3.1896	2.0203		2.0203
H6	1.2018	2.1724	3.1896	2.0203	2.0203

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.935
C2	B1	H5	103.935	C2	B1	H6	103.935
H4	B1	H5	114.394	H4	B1	H6	114.394
H5	B1	H6	114.394

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

using model chemistry: MP2/cc-pCVTZ

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-pCVTZ

States and conformations

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