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	hartrees
Energy at 0K	-65.872967
Energy at 298.15K	-65.876925
HF Energy	-65.470795
Nuclear repulsion energy	31.933147

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3098	2992
2	A'	2990	2887
3	A'	2594	2504
4	A'	1488	1437
5	A'	1337	1291
6	A'	1272	1228
7	A'	1095	1057
8	A'	983	949
9	A'	555	536
10	A"	3151	3042
11	A"	2667	2575
12	A"	1443	1393
13	A"	1074	1037
14	A"	687	663
15	A"	170	164

Atom	x (Å)	y (Å)	z (Å)
C1	-0.019	-0.682	0.000
B2	-0.019	0.870	0.000
H3	1.051	-0.940	0.000
H4	-0.437	-1.140	0.892
H5	-0.437	-1.140	-0.892
H6	0.015	1.480	-1.023
H7	0.015	1.480	1.023

	C1	B2	H3	H4	H5	H6	H7
C1		1.5516	1.1003	1.0870	1.0870	2.3921	2.3921
B2	1.5516		2.1021	2.2387	2.2387	1.1916	1.1916
H3	1.1003	2.1021		1.7466	1.7466	2.8241	2.8241
H4	1.0870	2.2387	1.7466		1.7849	3.2772	2.6625
H5	1.0870	2.2387	1.7466	1.7849		2.6625	3.2772
H6	2.3921	1.1916	2.8241	3.2772	2.6625		2.0455
H7	2.3921	1.1916	2.8241	2.6625	3.2772	2.0455

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.819	C1	B2	H7	120.819
B2	C1	H3	103.558	B2	C1	H4	114.946
B2	C1	H5	114.946	H3	C1	H4	105.972
H3	C1	H5	105.972	H4	C1	H5	110.374
H6	B2	H7	118.256

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: CCSD(T)=FULL/cc-pVQZ

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)=FULL/cc-pVQZ

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)