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	hartrees
Energy at 0K	-65.706031
Energy at 298.15K	-65.709991
HF Energy	-65.451957
Nuclear repulsion energy	31.787376

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3142	2975	12.29
2	A'	3036	2875	2.17
3	A'	2601	2463	106.49
4	A'	1523	1442	6.10
5	A'	1373	1301	78.44
6	A'	1272	1205	25.69
7	A'	1115	1056	69.68
8	A'	984	932	11.02
9	A'	576	545	0.58
10	A"	3197	3027	13.65
11	A"	2677	2536	155.50
12	A"	1489	1410	6.93
13	A"	1092	1034	21.96
14	A"	700	663	0.83
15	A"	157	149	1.67

Atom	x (Å)	y (Å)	z (Å)
C1	-0.018	-0.685	0.000
B2	-0.018	0.874	0.000
H3	1.051	-0.958	0.000
H4	-0.445	-1.140	0.895
H5	-0.445	-1.140	-0.895
H6	0.016	1.490	-1.028
H7	0.016	1.490	1.028

	C1	B2	H3	H4	H5	H6	H7
C1		1.5596	1.1027	1.0907	1.0907	2.4058	2.4058
B2	1.5596		2.1208	2.2451	2.2451	1.1983	1.1983
H3	1.1027	2.1208		1.7522	1.7522	2.8492	2.8492
H4	1.0907	2.2451	1.7522		1.7893	3.2898	2.6731
H5	1.0907	2.2451	1.7522	1.7893		2.6731	3.2898
H6	2.4058	1.1983	2.8492	3.2898	2.6731		2.0552
H7	2.4058	1.1983	2.8492	2.6731	3.2898	2.0552

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	B2	H6	120.904	C1	B2	H7	120.904
B2	C1	H3	104.300	B2	C1	H4	114.643
B2	C1	H5	114.643	H3	C1	H4	106.042
H3	C1	H5	106.042	H4	C1	H5	110.231
H6	B2	H7	118.092

All results from a given calculation for CH₃BH₂ (methylborane)

using model chemistry: MP2=FULL/6-311G*

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: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for CH₃BH₂ (methylborane)