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	hartrees
Energy at 0K	-139.631586
Energy at 298.15K	-139.634116
HF Energy	-139.223277
Nuclear repulsion energy	53.924872

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3086	2939	0.15
2	A₁	2028	1931	125.86
3	A₁	1404	1337	17.90
4	A₁	824	784	0.10
5	E	3170	3019	2.33
5	E	3170	3019	2.33
6	E	1516	1444	7.32
6	E	1516	1444	7.32
7	E	955	909	24.33
7	E	955	909	24.33
8	E	355	338	10.98
8	E	355	338	10.98

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.303
B2	0.000	0.000	0.242
O3	0.000	0.000	1.459
H4	0.000	1.026	-1.687
H5	0.889	-0.513	-1.687
H6	-0.889	-0.513	-1.687

	C1	B2	O3	H4	H5	H6
C1		1.5450	2.7621	1.0953	1.0953	1.0953
B2	1.5450		1.2171	2.1844	2.1844	2.1844
O3	2.7621	1.2171		3.3086	3.3086	3.3086
H4	1.0953	2.1844	3.3086		1.7770	1.7770
H5	1.0953	2.1844	3.3086	1.7770		1.7770
H6	1.0953	2.1844	3.3086	1.7770	1.7770

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.493
B2	C1	H5	110.493	B2	C1	H6	110.493
H4	C1	H5	108.431	H4	C1	H6	108.431
H5	C1	H6	108.431

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

using model chemistry: QCISD/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 CH3BO (Borane, methyloxo-)

using model chemistry: QCISD/6-31G*

States and conformations

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