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	hartrees
Energy at 0K	-139.449870
Energy at 298.15K	-139.452390
HF Energy	-139.164743
Nuclear repulsion energy	53.384219

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3076	2923	0.79
2	A₁	1910	1815	69.83
3	A₁	1447	1375	27.52
4	A₁	813	772	0.00
5	E	3165	3007	3.90
5	E	3165	3007	3.90
6	E	1539	1462	9.64
6	E	1539	1462	9.64
7	E	988	939	24.62
7	E	988	939	24.62
8	E	341	324	8.68
8	E	341	324	8.68

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.313
B2	0.000	0.000	0.235
O3	0.000	0.000	1.477
H4	0.000	1.027	-1.703
H5	0.889	-0.513	-1.703
H6	-0.889	-0.513	-1.703

	C1	B2	O3	H4	H5	H6
C1		1.5479	2.7905	1.0979	1.0979	1.0979
B2	1.5479		1.2425	2.1924	2.1924	2.1924
O3	2.7905	1.2425		3.3413	3.3413	3.3413
H4	1.0979	2.1924	3.3413		1.7780	1.7780
H5	1.0979	2.1924	3.3413	1.7780		1.7780
H6	1.0979	2.1924	3.3413	1.7780	1.7780

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.767
B2	C1	H5	110.767	B2	C1	H6	110.767
H4	C1	H5	108.145	H4	C1	H6	108.145
H5	C1	H6	108.145

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

using model chemistry: MP2=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 CH3BO (Borane, methyloxo-)

using model chemistry: MP2=FULL/6-31G

States and conformations

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