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	hartrees
Energy at 0K	-139.601257
Energy at 298.15K	-139.603502
HF Energy	-139.144085
Nuclear repulsion energy	55.960252

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2531	2531
2	A₁	2234	2234
3	A₁	1135	1135
4	A₁	682	682
5	E	2615	2615
5	E	2614	2614
6	E	1163	1163
6	E	1163	1163
7	E	849	849
7	E	849	849
8	E	302	302
8	E	301	301

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.370
C2	0.000	0.000	0.192
O3	0.000	0.000	1.333
H4	0.000	1.168	-1.654
H5	1.011	-0.584	-1.654
H6	-1.011	-0.584	-1.654

	B1	C2	O3	H4	H5	H6
B1		1.5617	2.7030	1.2018	1.2018	1.2018
C2	1.5617		1.1413	2.1842	2.1842	2.1842
O3	2.7030	1.1413		3.2073	3.2073	3.2073
H4	1.2018	2.1842	3.2073		2.0226	2.0226
H5	1.2018	2.1842	3.2073	2.0226		2.0226
H6	1.2018	2.1842	3.2073	2.0226	2.0226

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.676
C2	B1	H5	103.676	C2	B1	H6	103.676
H4	B1	H5	114.592	H4	B1	H6	114.592
H5	B1	H6	114.592

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

using model chemistry: QCISD(TQ)=FULL/6-31+G**

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(TQ)=FULL/6-31+G**

States and conformations

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