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	hartrees
Energy at 0K	-139.610296
Energy at 298.15K	-139.612514
HF Energy	-139.149583
Nuclear repulsion energy	55.378300

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2491	2404
2	A₁	2053	1981
3	A₁	1101	1063
4	A₁	675	651
5	E	2579	2489
5	E	2579	2489
6	E	1139	1099
6	E	1138	1099
7	E	832	803
7	E	832	803
8	E	296	286
8	E	296	286

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.383
C2	0.000	0.000	0.194
O3	0.000	0.000	1.346
H4	0.000	1.186	-1.672
H5	1.027	-0.593	-1.672
H6	-1.027	-0.593	-1.672

	B1	C2	O3	H4	H5	H6
B1		1.5779	2.7292	1.2207	1.2207	1.2207
C2	1.5779		1.1513	2.2117	2.2117	2.2117
O3	2.7292	1.1513		3.2428	3.2428	3.2428
H4	1.2207	2.2117	3.2428		2.0543	2.0543
H5	1.2207	2.2117	3.2428	2.0543		2.0543
H6	1.2207	2.2117	3.2428	2.0543	2.0543

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	103.687
C2	B1	H5	103.687	C2	B1	H6	103.687
H4	B1	H5	114.584	H4	B1	H6	114.584
H5	B1	H6	114.584

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

using model chemistry: MP4=FULL/cc-pVDZ

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: MP4=FULL/cc-pVDZ

States and conformations

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