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	hartrees
Energy at 0K	-139.577863
Energy at 298.15K	-139.580100
HF Energy	-139.135597
Nuclear repulsion energy	55.651834

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2512	2416
2	A₁	2054	1975
3	A₁	1121	1078
4	A₁	706	678
5	E	2596	2497
5	E	2596	2497
6	E	1146	1102
6	E	1146	1102
7	E	846	813
7	E	846	813
8	E	302	290
8	E	301	290

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.367
C2	0.000	0.000	0.184
O3	0.000	0.000	1.340
H4	0.000	1.173	-1.664
H5	1.016	-0.587	-1.664
H6	-1.016	-0.587	-1.664

	B1	C2	O3	H4	H5	H6
B1		1.5515	2.7073	1.2105	1.2105	1.2105
C2	1.5515		1.1558	2.1895	2.1895	2.1895
O3	2.7073	1.1558		3.2253	3.2253	3.2253
H4	1.2105	2.1895	3.2253		2.0326	2.0326
H5	1.2105	2.1895	3.2253	2.0326		2.0326
H6	1.2105	2.1895	3.2253	2.0326	2.0326

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	104.201
C2	B1	H5	104.201	C2	B1	H6	104.201
H4	B1	H5	114.187	H4	B1	H6	114.187
H5	B1	H6	114.187

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

using model chemistry: MP4=FULL/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: MP4=FULL/6-31G*

States and conformations

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