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	hartrees
Energy at 0K	-137.598087
Energy at 298.15K	-137.600554
HF Energy	-137.421091
Nuclear repulsion energy	53.550141

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3375	3000	0.03
2	A₁	2176	1934	0.58
3	A₁	1580	1405	0.63
4	A₁	875	778	1.48
5	E	3547	3153	0.06
5	E	3547	3153	0.06
6	E	1724	1532	1.38
6	E	1724	1532	1.38
7	E	1072	953	15.91
7	E	1072	953	15.91
8	E	358	318	3.50
8	E	358	318	3.50

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.314
B2	0.000	0.000	0.250
O3	0.000	0.000	1.470
H4	0.000	1.029	-1.709
H5	0.891	-0.514	-1.709
H6	-0.891	-0.514	-1.709

	C1	B2	O3	H4	H5	H6
C1		1.5637	2.7834	1.1025	1.1025	1.1025
B2	1.5637		1.2197	2.2134	2.2134	2.2134
O3	2.7834	1.2197		3.3417	3.3417	3.3417
H4	1.1025	2.2134	3.3417		1.7821	1.7821
H5	1.1025	2.2134	3.3417	1.7821		1.7821
H6	1.1025	2.2134	3.3417	1.7821	1.7821

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	111.049
B2	C1	H5	111.049	B2	C1	H6	111.049
H4	C1	H5	107.849	H4	C1	H6	107.849
H5	C1	H6	107.849

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

using model chemistry: MP2=FULL/STO-3G

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/STO-3G

States and conformations

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