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	hartrees
Energy at 0K	-65.735612
Energy at 298.15K	-65.739529
HF Energy	-65.447495
Nuclear repulsion energy	31.438878

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3070	2954
2	A'	2963	2852
3	A'	2558	2462
4	A'	1459	1404
5	A'	1315	1265
6	A'	1242	1195
7	A'	1079	1038
8	A'	960	924
9	A'	549	528
10	A"	3122	3005
11	A"	2627	2529
12	A"	1414	1361
13	A"	1055	1015
14	A"	669	644
15	A"	159	153

Atom	x (Å)	y (Å)	z (Å)
C1	-0.018	-0.692	0.000
B2	-0.018	0.884	0.000
H3	1.065	-0.964	0.000
H4	-0.448	-1.155	0.906
H5	-0.448	-1.155	-0.906
H6	0.014	1.504	-1.039
H7	0.014	1.504	1.039

	C1	B2	H3	H4	H5	H6	H7
C1		1.5755	1.1171	1.1044	1.1044	2.4294	2.4294
B2	1.5755		2.1421	2.2720	2.2720	1.2107	1.2107
H3	1.1171	2.1421		1.7736	1.7736	2.8770	2.8770
H4	1.1044	2.2720	1.7736		1.8114	3.3267	2.7020
H5	1.1044	2.2720	1.7736	1.8114		2.7020	3.3267
H6	2.4294	1.2107	2.8770	3.3267	2.7020		2.0788
H7	2.4294	1.2107	2.8770	2.7020	3.3267	2.0788

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.807	C1	B2	H7	120.807
B2	C1	H3	104.115	B2	C1	H4	114.813
B2	C1	H5	114.813	H3	C1	H4	105.953
H3	C1	H5	105.953	H4	C1	H5	110.197
H6	B2	H7	118.297

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: CCSD(T)/aug-cc-pVDZ

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 CH3BH2 (methylborane)

using model chemistry: CCSD(T)/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)