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	hartrees
Energy at 0K	-139.547779
Energy at 298.15K
HF Energy	-139.138750
Nuclear repulsion energy	55.829884

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2515	2395	5.26
2	A₁	2217	2111	311.34
3	A₁	1133	1079	12.16
4	A₁	680	648	25.71
5	E	2597	2473	53.31
5	E	2597	2473	53.31
6	E	1155	1100	0.01
6	E	1155	1100	0.01
7	E	861	819	0.93
7	E	861	819	0.93
8	E	306	291	14.06
8	E	306	291	14.06

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.372
C2	0.000	0.000	0.194
O3	0.000	0.000	1.335
H4	0.000	1.175	-1.662
H5	1.017	-0.587	-1.662
H6	-1.017	-0.587	-1.662

	B1	C2	O3	H4	H5	H6
B1		1.5653	2.7070	1.2101	1.2101	1.2101
C2	1.5653		1.1417	2.1964	2.1964	2.1964
O3	2.7070	1.1417		3.2195	3.2195	3.2195
H4	1.2101	2.1964	3.2195		2.0347	2.0347
H5	1.2101	2.1964	3.2195	2.0347		2.0347
H6	1.2101	2.1964	3.2195	2.0347	2.0347

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.894
C2	B1	H5	103.894	C2	B1	H6	103.894
H4	B1	H5	114.426	H4	B1	H6	114.426
H5	B1	H6	114.426

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

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

States and conformations

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