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	hartrees
Energy at 0K	-139.567096
Energy at 298.15K
HF Energy	-139.142520
Nuclear repulsion energy	55.921246

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2551	2379	7.11
2	A₁	2265	2113	299.29
3	A₁	1156	1078	28.53
4	A₁	661	616	21.94
5	E	2638	2460	62.40
5	E	2638	2460	62.40
6	E	1184	1104	0.19
6	E	1184	1104	0.19
7	E	871	813	0.27
7	E	871	813	0.27
8	E	301	281	15.40
8	E	301	281	15.40

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.377
C2	0.000	0.000	0.197
O3	0.000	0.000	1.334
H4	0.000	1.168	-1.657
H5	1.011	-0.584	-1.657
H6	-1.011	-0.584	-1.657

	B1	C2	O3	H4	H5	H6
B1		1.5738	2.7114	1.2008	1.2008	1.2008
C2	1.5738		1.1376	2.1906	2.1906	2.1906
O3	2.7114	1.1376		3.2109	3.2109	3.2109
H4	1.2008	2.1906	3.2109		2.0227	2.0227
H5	1.2008	2.1906	3.2109	2.0227		2.0227
H6	1.2008	2.1906	3.2109	2.0227	2.0227

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.464
C2	B1	H5	103.464	C2	B1	H6	103.464
H4	B1	H5	114.752	H4	B1	H6	114.752
H5	B1	H6	114.752

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

using model chemistry: CCSD/6-31G**

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/6-31G**

States and conformations

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