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	hartrees
Energy at 0K	-139.586781
Energy at 298.15K
HF Energy	-139.171025
Nuclear repulsion energy	56.093477

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2494	2370	3.82	218.20	0.00	0.00
2	A₁	2175	2067	265.61	131.33	0.31	0.47
3	A₁	1112	1057	8.59	25.95	0.51	0.68
4	A₁	708	673	35.22	0.48	0.02	0.04
5	E	2581	2452	51.22	113.75	0.75	0.86
5	E	2581	2452	51.22	113.75	0.75	0.86
6	E	1144	1087	0.06	21.97	0.75	0.86
6	E	1144	1087	0.06	21.97	0.75	0.86
7	E	849	807	1.28	0.38	0.75	0.86
7	E	849	807	1.28	0.38	0.75	0.86
8	E	314	299	8.66	0.29	0.75	0.86
8	E	314	299	8.66	0.29	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
B1	0.000	0.000	-1.360
C2	0.000	0.000	0.191
O3	0.000	0.000	1.329
H4	0.000	1.170	-1.659
H5	1.014	-0.585	-1.659
H6	-1.014	-0.585	-1.659

	B1	C2	O3	H4	H5	H6
B1		1.5506	2.6887	1.2080	1.2080	1.2080
C2	1.5506		1.1381	2.1889	2.1889	2.1889
O3	2.6887	1.1381		3.2088	3.2088	3.2088
H4	1.2080	2.1889	3.2088		2.0271	2.0271
H5	1.2080	2.1889	3.2088	2.0271		2.0271
H6	1.2080	2.1889	3.2088	2.0271	2.0271

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
B1	C2	O3	180.000	C2	B1	H4	104.336
C2	B1	H5	104.336	C2	B1	H6	104.336
H4	B1	H5	114.082	H4	B1	H6	114.082
H5	B1	H6	114.082

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

using model chemistry: MP2/6-311G*

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: MP2/6-311G*

States and conformations

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