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	hartrees
Energy at 0K	-139.539149
Energy at 298.15K	-139.541404
HF Energy	-139.139745
Nuclear repulsion energy	55.989569

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2525	2390	6.06
2	A₁	2291	2168	332.50
3	A₁	1138	1077	14.88
4	A₁	677	641	25.59
5	E	2610	2471	50.56
5	E	2610	2471	50.56
6	E	1160	1098	0.02
6	E	1160	1098	0.02
7	E	866	819	0.90
7	E	866	819	0.90
8	E	307	291	14.25
8	E	307	291	14.25

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.369
C2	0.000	0.000	0.196
O3	0.000	0.000	1.331
H4	0.000	1.174	-1.659
H5	1.017	-0.587	-1.659
H6	-1.017	-0.587	-1.659

	B1	C2	O3	H4	H5	H6
B1		1.5654	2.7006	1.2094	1.2094	1.2094
C2	1.5654		1.1352	2.1955	2.1955	2.1955
O3	2.7006	1.1352		3.2126	3.2126	3.2126
H4	1.2094	2.1955	3.2126		2.0337	2.0337
H5	1.2094	2.1955	3.2126	2.0337		2.0337
H6	1.2094	2.1955	3.2126	2.0337	2.0337

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.861
C2	B1	H5	103.861	C2	B1	H6	103.861
H4	B1	H5	114.451	H4	B1	H6	114.451
H5	B1	H6	114.451

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

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

States and conformations

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