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	hartrees
Energy at 0K	-139.560147
Energy at 298.15K	-139.562377
HF Energy	-139.138058
Nuclear repulsion energy	55.815749

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2505	2410
2	A₁	2199	2115
3	A₁	1122	1079
4	A₁	693	667
5	E	2586	2488
5	E	2586	2488
6	E	1146	1102
6	E	1146	1102
7	E	850	818
7	E	850	818
8	E	300	289
8	E	300	288

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.369
C2	0.000	0.000	0.191
O3	0.000	0.000	1.335
H4	0.000	1.176	-1.660
H5	1.018	-0.588	-1.660
H6	-1.018	-0.588	-1.660

	B1	C2	O3	H4	H5	H6
B1		1.5597	2.7045	1.2111	1.2111	1.2111
C2	1.5597		1.1448	2.1924	2.1924	2.1924
O3	2.7045	1.1448		3.2178	3.2178	3.2178
H4	1.2111	2.1924	3.2178		2.0364	2.0364
H5	1.2111	2.1924	3.2178	2.0364		2.0364
H6	1.2111	2.1924	3.2178	2.0364	2.0364

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.895
C2	B1	H5	103.895	C2	B1	H6	103.895
H4	B1	H5	114.425	H4	B1	H6	114.425
H5	B1	H6	114.425

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

using model chemistry: CCSD(T)/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(T)/6-31G*

States and conformations

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