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	hartrees
Energy at 0K	-139.713465
Energy at 298.15K	-139.716020
HF Energy	-139.239559
Nuclear repulsion energy	54.162710

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3126	2952	0.49
2	A₁	2013	1901	101.52
3	A₁	1352	1277	14.27
4	A₁	831	785	0.09
5	E	3225	3046	0.01
5	E	3225	3046	0.01
6	E	1488	1405	5.99
6	E	1488	1405	5.99
7	E	919	868	23.28
7	E	919	868	23.28
8	E	370	349	8.83
8	E	370	349	8.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.297
B2	0.000	0.000	0.239
O3	0.000	0.000	1.453
H4	0.000	1.021	-1.677
H5	0.884	-0.511	-1.677
H6	-0.884	-0.511	-1.677

	C1	B2	O3	H4	H5	H6
C1		1.5358	2.7497	1.0897	1.0897	1.0897
B2	1.5358		1.2139	2.1712	2.1712	2.1712
O3	2.7497	1.2139		3.2924	3.2924	3.2924
H4	1.0897	2.1712	3.2924		1.7688	1.7688
H5	1.0897	2.1712	3.2924	1.7688		1.7688
H6	1.0897	2.1712	3.2924	1.7688	1.7688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.424
B2	C1	H5	110.424	B2	C1	H6	110.424
H4	C1	H5	108.501	H4	C1	H6	108.501
H5	C1	H6	108.501

All results from a given calculation for CH₃BO (Borane, methyloxo-)

using model chemistry: MP2/6-31G(2df,p)

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 CH3BO (Borane, methyloxo-)

using model chemistry: MP2/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₃BO (Borane, methyloxo-)