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	hartrees
Energy at 0K	-65.826406
Energy at 298.15K	-65.830391
HF Energy	-65.466828
Nuclear repulsion energy	31.917216

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3103	2951	11.65
2	A'	3005	2857	5.26
3	A'	2604	2477	106.98
4	A'	1509	1435	2.15
5	A'	1356	1290	62.49
6	A'	1280	1217	23.22
7	A'	1100	1046	61.21
8	A'	984	935	12.14
9	A'	560	532	0.81
10	A"	3145	2991	16.01
11	A"	2671	2540	152.23
12	A"	1462	1391	3.51
13	A"	1083	1030	17.97
14	A"	687	654	1.49
15	A"	179	171	0.88

Atom	x (Å)	y (Å)	z (Å)
C1	-0.018	-0.683	0.000
B2	-0.018	0.872	0.000
H3	1.050	-0.944	0.000
H4	-0.440	-1.139	0.892
H5	-0.440	-1.139	-0.892
H6	0.015	1.481	-1.021
H7	0.015	1.481	1.021

	C1	B2	H3	H4	H5	H6	H7
C1		1.5547	1.1000	1.0870	1.0870	2.3928	2.3928
B2	1.5547		2.1068	2.2400	2.2400	1.1893	1.1893
H3	1.1000	2.1068		1.7480	1.7480	2.8275	2.8275
H4	1.0870	2.2400	1.7480		1.7834	3.2758	2.6626
H5	1.0870	2.2400	1.7480	1.7834		2.6626	3.2758
H6	2.3928	1.1893	2.8275	3.2758	2.6626		2.0419
H7	2.3928	1.1893	2.8275	2.6626	3.2758	2.0419

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.811	C1	B2	H7	120.811
B2	C1	H3	103.725	B2	C1	H4	114.825
B2	C1	H5	114.825	H3	C1	H4	106.119
H3	C1	H5	106.119	H4	C1	H5	110.232
H6	B2	H7	118.280

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: CCSD=FULL/aug-cc-pVTZ

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=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)