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	hartrees
Energy at 0K	-139.709892
Energy at 298.15K	-139.712142
HF Energy	-139.186746
Nuclear repulsion energy	56.158349

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2494	2384
2	A₁	2212	2115
3	A₁	1126	1076
4	A₁	674	645
5	E	2577	2464
5	E	2577	2463
6	E	1161	1110
6	E	1160	1109
7	E	853	815
7	E	853	815
8	E	301	288
8	E	300	287

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.365
C2	0.000	0.000	0.195
O3	0.000	0.000	1.327
H4	0.000	1.169	-1.655
H5	1.012	-0.584	-1.655
H6	-1.012	-0.584	-1.655

	B1	C2	O3	H4	H5	H6
B1		1.5600	2.6925	1.2043	1.2043	1.2043
C2	1.5600		1.1325	2.1880	2.1880	2.1880
O3	2.6925	1.1325		3.2030	3.2030	3.2030
H4	1.2043	2.1880	3.2030		2.0247	2.0247
H5	1.2043	2.1880	3.2030	2.0247		2.0247
H6	1.2043	2.1880	3.2030	2.0247	2.0247

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.913
C2	B1	H5	103.913	C2	B1	H6	103.913
H4	B1	H5	114.411	H4	B1	H6	114.411
H5	B1	H6	114.411

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

using model chemistry: CCSD(T)=FULL/TZVP

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(T)=FULL/TZVP

States and conformations

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