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	hartrees
Energy at 0K	-138.669857
Energy at 298.15K	-138.672146
HF Energy	-138.346795
Nuclear repulsion energy	54.682688

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2475	2400
2	A₁	1865	1808
3	A₁	1128	1094
4	A₁	643	624
5	E	2554	2477
5	E	2554	2477
6	E	1150	1115
6	E	1150	1115
7	E	875	849
7	E	875	849
8	E	323	313
8	E	323	313

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.394
C2	0.000	0.000	0.190
O3	0.000	0.000	1.368
H4	0.000	1.178	-1.704
H5	1.020	-0.589	-1.704
H6	-1.020	-0.589	-1.704

	B1	C2	O3	H4	H5	H6
B1		1.5841	2.7617	1.2182	1.2182	1.2182
C2	1.5841		1.1776	2.2303	2.2303	2.2303
O3	2.7617	1.1776		3.2895	3.2895	3.2895
H4	1.2182	2.2303	3.2895		2.0407	2.0407
H5	1.2182	2.2303	3.2895	2.0407		2.0407
H6	1.2182	2.2303	3.2895	2.0407	2.0407

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	104.724
C2	B1	H5	104.724	C2	B1	H6	104.724
H4	B1	H5	113.772	H4	B1	H6	113.772
H5	B1	H6	113.772

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

using model chemistry: MP4/3-21G

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: MP4/3-21G

States and conformations

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