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	hartrees
Energy at 0K	-65.728192
Energy at 298.15K	-65.732114
HF Energy	-65.447629
Nuclear repulsion energy	31.468195

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3087	2974	16.97
2	A'	2986	2877	4.56
3	A'	2569	2475	110.94
4	A'	1470	1416	1.53
5	A'	1328	1280	58.78
6	A'	1250	1205	27.42
7	A'	1086	1046	58.89
8	A'	965	929	10.74
9	A'	562	541	0.92
10	A"	3138	3023	21.04
11	A"	2637	2540	159.55
12	A"	1427	1375	2.86
13	A"	1063	1024	18.45
14	A"	675	650	2.13
15	A"	151	146	0.70

Atom	x (Å)	y (Å)	z (Å)
C1	-0.017	-0.692	0.000
B2	-0.017	0.883	0.000
H3	1.062	-0.970	0.000
H4	-0.450	-1.152	0.904
H5	-0.450	-1.152	-0.904
H6	0.014	1.503	-1.038
H7	0.014	1.503	1.038

	C1	B2	H3	H4	H5	H6	H7
C1		1.5748	1.1148	1.1028	1.1028	2.4279	2.4279
B2	1.5748		2.1445	2.2683	2.2683	1.2095	1.2095
H3	1.1148	2.1445		1.7715	1.7715	2.8795	2.8795
H4	1.1028	2.2683	1.7715		1.8075	3.3217	2.6983
H5	1.1028	2.2683	1.7715	1.8075		2.6983	3.3217
H6	2.4279	1.2095	2.8795	3.3217	2.6983		2.0764
H7	2.4279	1.2095	2.8795	2.6983	3.3217	2.0764

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.827	C1	B2	H7	120.827
B2	C1	H3	104.453	B2	C1	H4	114.659
B2	C1	H5	114.659	H3	C1	H4	106.041
H3	C1	H5	106.041	H4	C1	H5	110.068
H6	B2	H7	118.260

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: CCSD/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/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)