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	hartrees
Energy at 0K	-156.775239
Energy at 298.15K	-156.784375
HF Energy	-156.111128
Nuclear repulsion energy	125.958879

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3117	3045
2	A₁	3078	3007
3	A₁	1570	1534
4	A₁	1209	1182
5	A₁	1045	1021
6	A₁	242	236
7	A₂	1273	1243
8	A₂	975	953
9	B₁	1289	1259
10	B₁	1187	1160
11	B₁	965	943
12	B₂	3144	3071
13	B₂	3071	3000
14	B₂	1537	1502
15	B₂	926	905
16	B₂	640	626
17	E	3129	3057
17	E	3129	3057
18	E	3072	3001
18	E	3072	3001
19	E	1531	1496
19	E	1531	1496
20	E	1321	1290
20	E	1321	1290
21	E	1271	1241
21	E	1271	1241
22	E	937	916
22	E	937	916
23	E	775	757
23	E	775	757

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	1.087	0.147
C2	0.000	-1.087	0.147
C3	-1.087	0.000	-0.147
C4	1.087	0.000	-0.147
H5	0.000	1.363	1.217
H6	0.000	2.005	-0.464
H7	0.000	-1.363	1.217
H8	0.000	-2.005	-0.464
H9	-1.363	0.000	-1.217
H10	-2.005	0.000	0.464
H11	1.363	0.000	-1.217
H12	2.005	0.000	0.464

	C1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12
C1		2.1735	1.5648	1.5648	1.1052	1.1035	2.6731	3.1521	2.2135	2.3030	2.2135	2.3030
C2	2.1735		1.5648	1.5648	2.6731	3.1521	1.1052	1.1035	2.2135	2.3030	2.2135	2.3030
C3	1.5648	1.5648		2.1735	2.2135	2.3030	2.2135	2.3030	1.1052	1.1035	2.6731	3.1521
C4	1.5648	1.5648	2.1735		2.2135	2.3030	2.2135	2.3030	2.6731	3.1521	1.1052	1.1035
H5	1.1052	2.6731	2.2135	2.2135		1.8002	2.7255	3.7646	3.1050	2.5389	3.1050	2.5389
H6	1.1035	3.1521	2.3030	2.3030	1.8002		3.7646	4.0110	2.5389	2.9843	2.5389	2.9843
H7	2.6731	1.1052	2.2135	2.2135	2.7255	3.7646		1.8002	3.1050	2.5389	3.1050	2.5389
H8	3.1521	1.1035	2.3030	2.3030	3.7646	4.0110	1.8002		2.5389	2.9843	2.5389	2.9843
H9	2.2135	2.2135	1.1052	2.6731	3.1050	2.5389	3.1050	2.5389		1.8002	2.7255	3.7646
H10	2.3030	2.3030	1.1035	3.1521	2.5389	2.9843	2.5389	2.9843	1.8002		3.7646	4.0110
H11	2.2135	2.2135	2.6731	1.1052	3.1050	2.5389	3.1050	2.5389	2.7255	3.7646		1.8002
H12	2.3030	2.3030	3.1521	1.1035	2.5389	2.9843	2.5389	2.9843	3.7646	4.0110	1.8002

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C2	87.976	C1	C3	H9	110.818
C1	C3	H10	118.300	C1	C4	C2	87.976
C1	C4	H11	110.818	C1	C4	H12	118.300
C2	C3	H9	110.818	C2	C3	H10	118.300
C2	C4	H11	110.818	C2	C4	H12	118.300
C3	C1	C4	87.976	C3	C1	H5	110.818
C3	C1	H6	118.300	C3	C2	C4	87.976
C3	C2	H7	110.818	C3	C2	H8	118.300
C4	C1	H5	110.818	C4	C1	H6	118.300
C4	C2	H7	110.818	C4	C2	H8	118.300
H5	C1	H6	109.181	H7	C2	H8	109.181
H9	C3	H10	109.181	H11	C4	H12	109.181

All results from a given calculation for C₄H₈ (cyclobutane)

using model chemistry: MP4/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 C4H8 (cyclobutane)

using model chemistry: MP4/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₄H₈ (cyclobutane)