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	hartrees
Energy at 0K	-139.465188
Energy at 298.15K	-139.467790
HF Energy	-139.190743
Nuclear repulsion energy	53.128070

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3046	2941	2.15
2	A₁	1913	1846	99.45
3	A₁	1429	1379	31.18
4	A₁	809	781	0.21
5	E	3151	3042	7.03
5	E	3151	3042	7.03
6	E	1510	1458	12.08
6	E	1510	1458	12.08
7	E	987	952	22.77
7	E	987	952	22.77
8	E	384	371	7.63
8	E	384	371	7.63

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.320
B2	0.000	0.000	0.234
O3	0.000	0.000	1.484
H4	0.000	1.032	-1.708
H5	0.894	-0.516	-1.708
H6	-0.894	-0.516	-1.708

	C1	B2	O3	H4	H5	H6
C1		1.5538	2.8041	1.1025	1.1025	1.1025
B2	1.5538		1.2503	2.1989	2.1989	2.1989
O3	2.8041	1.2503		3.3547	3.3547	3.3547
H4	1.1025	2.1989	3.3547		1.7875	1.7875
H5	1.1025	2.1989	3.3547	1.7875		1.7875
H6	1.1025	2.1989	3.3547	1.7875	1.7875

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.601
B2	C1	H5	110.601	B2	C1	H6	110.601
H4	C1	H5	108.318	H4	C1	H6	108.318
H5	C1	H6	108.318

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

using model chemistry: MP2/SDD

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/SDD

States and conformations

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