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	hartrees
Energy at 0K	-139.688339
Energy at 298.15K	-139.690882
HF Energy	-139.233928
Nuclear repulsion energy	54.029699

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3107	3107
2	A₁	2035	2035
3	A₁	1385	1385
4	A₁	820	820
5	E	3201	3201
5	E	3200	3200
6	E	1499	1499
6	E	1499	1499
7	E	944	944
7	E	944	944
8	E	360	360
8	E	360	360

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.302
B2	0.000	0.000	0.240
O3	0.000	0.000	1.457
H4	0.000	1.022	-1.680
H5	0.885	-0.511	-1.680
H6	-0.885	-0.511	-1.680

	C1	B2	O3	H4	H5	H6
C1		1.5426	2.7592	1.0898	1.0898	1.0898
B2	1.5426		1.2166	2.1754	2.1754	2.1754
O3	2.7592	1.2166		3.2993	3.2993	3.2993
H4	1.0898	2.1754	3.2993		1.7706	1.7706
H5	1.0898	2.1754	3.2993	1.7706		1.7706
H6	1.0898	2.1754	3.2993	1.7706	1.7706

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	O3	180.000	B2	C1	H4	110.276
B2	C1	H5	110.276	B2	C1	H6	110.276
H4	C1	H5	108.654	H4	C1	H6	108.654
H5	C1	H6	108.654

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

using model chemistry: QCISD(TQ)=FULL/6-31+G**

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(TQ)=FULL/6-31+G**

States and conformations

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