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	hartrees
Energy at 0K	-156.387943
Energy at 298.15K	-156.397216
HF Energy	-156.029514
Nuclear repulsion energy	126.045148

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3167	2962	0.00
2	A₁	3130	2927	0.00
3	A₁	1607	1503	0.00
4	A₁	1255	1174	0.00
5	A₁	1038	971	0.00
6	A₁	220	205	0.00
7	A₂	1348	1260	0.00
8	A₂	1009	944	0.00
9	B₁	1328	1242	0.00
10	B₁	1230	1150	0.00
11	B₁	972	909	0.00
12	B₂	3195	2988	105.69
13	B₂	3118	2916	13.99
14	B₂	1586	1483	4.31
15	B₂	950	888	0.00
16	B₂	669	626	2.60
17	E	3176	2971	22.79
17	E	3176	2971	22.79
18	E	3120	2917	65.24
18	E	3120	2917	65.24
19	E	1579	1477	1.56
19	E	1579	1477	1.56
20	E	1369	1280	1.67
20	E	1369	1280	1.67
21	E	1303	1218	0.25
21	E	1303	1218	0.25
22	E	940	879	4.05
22	E	940	879	4.05
23	E	799	747	0.20
23	E	799	747	0.20

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.092	0.128
C2	0.000	-1.092	0.128
C3	-1.092	0.000	-0.128
C4	1.092	0.000	-0.128
H5	0.000	1.424	1.172
H6	0.000	1.974	-0.518
H7	0.000	-1.424	1.172
H8	0.000	-1.974	-0.518
H9	-1.424	0.000	-1.172
H10	-1.974	0.000	0.518
H11	1.424	0.000	-1.172
H12	1.974	0.000	0.518

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		2.1850	1.5661	1.5661	1.0952	1.0932	2.7240	3.1340	2.2158	2.2898	2.2158	2.2898
C2	2.1850		1.5661	1.5661	2.7240	3.1340	1.0952	1.0932	2.2158	2.2898	2.2158	2.2898
C3	1.5661	1.5661		2.1850	2.2158	2.2898	2.2158	2.2898	1.0952	1.0932	2.7240	3.1340
C4	1.5661	1.5661	2.1850		2.2158	2.2898	2.2158	2.2898	2.7240	3.1340	1.0952	1.0932
H5	1.0952	2.7240	2.2158	2.2158		1.7777	2.8471	3.7949	3.0897	2.5200	3.0897	2.5200
H6	1.0932	3.1340	2.2898	2.2898	1.7777		3.7949	3.9482	2.5200	2.9781	2.5200	2.9781
H7	2.7240	1.0952	2.2158	2.2158	2.8471	3.7949		1.7777	3.0897	2.5200	3.0897	2.5200
H8	3.1340	1.0932	2.2898	2.2898	3.7949	3.9482	1.7777		2.5200	2.9781	2.5200	2.9781
H9	2.2158	2.2158	1.0952	2.7240	3.0897	2.5200	3.0897	2.5200		1.7777	2.8471	3.7949
H10	2.2898	2.2898	1.0932	3.1340	2.5200	2.9781	2.5200	2.9781	1.7777		3.7949	3.9482
H11	2.2158	2.2158	2.7240	1.0952	3.0897	2.5200	3.0897	2.5200	2.8471	3.7949		1.7777
H12	2.2898	2.2898	3.1340	1.0932	2.5200	2.9781	2.5200	2.9781	3.7949	3.9482	1.7777

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C2	88.470	C1	C3	H9	111.509
C1	C3	H10	117.773	C1	C4	C2	88.470
C1	C4	H11	111.509	C1	C4	H12	117.773
C2	C3	H9	111.509	C2	C3	H10	117.773
C2	C4	H11	111.509	C2	C4	H12	117.773
C3	C1	C4	88.470	C3	C1	H5	111.509
C3	C1	H6	117.773	C3	C2	C4	88.470
C3	C2	H7	111.509	C3	C2	H8	117.773
C4	C1	H5	111.509	C4	C1	H6	117.773
C4	C2	H7	111.509	C4	C2	H8	117.773
H5	C1	H6	108.654	H7	C2	H8	108.654
H9	C3	H10	108.654	H11	C4	H12	108.654

All results from a given calculation for C₄H₈ (cyclobutane)

using model chemistry: CID/6-31G

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 C4H8 (cyclobutane)

using model chemistry: CID/6-31G

States and conformations

All results from a given calculation for C₄H₈ (cyclobutane)