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	hartrees
Energy at 0K	-194.518817
Energy at 298.15K	-194.527467
HF Energy	-193.942459
Nuclear repulsion energy	168.237792

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3266	3017	6.94
2	A'	3250	3002	47.86
3	A'	3222	2976	15.33
4	A'	3193	2949	38.07
5	A'	3171	2929	10.05
6	A'	1869	1726	14.97
7	A'	1602	1480	0.01
8	A'	1571	1451	1.90
9	A'	1523	1407	0.90
10	A'	1350	1247	0.28
11	A'	1291	1193	0.04
12	A'	1161	1073	0.21
13	A'	1030	951	0.41
14	A'	963	889	45.23
15	A'	941	869	0.70
16	A'	790	730	1.44
17	A'	697	643	1.51
18	A'	398	368	5.04
19	A'	108	100	0.03
20	A"	3347	3092	13.08
21	A"	3225	2979	15.41
22	A"	3167	2925	42.15
23	A"	1562	1443	2.53
24	A"	1372	1267	0.12
25	A"	1324	1223	0.22
26	A"	1292	1193	1.12
27	A"	1267	1171	1.84
28	A"	1102	1018	0.10
29	A"	990	915	1.35
30	A"	963	889	0.76
31	A"	860	794	0.14
32	A"	683	631	0.13
33	A"	368	340	0.09

Atom	x (Å)	y (Å)	z (Å)
C1	0.178	-0.423	1.087
C2	0.178	-0.423	-1.087
C3	0.000	0.619	0.000
C4	-0.031	-1.506	0.000
C5	-0.326	1.899	0.000
H6	-0.525	-0.400	1.919
H7	-0.525	-0.400	-1.919
H8	1.191	-0.431	1.491
H9	1.191	-0.431	-1.491
H10	-0.467	2.447	0.921
H11	-0.467	2.447	-0.921
H12	0.661	-2.345	0.000
H13	-1.048	-1.891	0.000

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		2.1749	1.5164	1.5491	2.6126	1.0889	3.0874	1.0909	2.7704	2.9462	3.5619	2.2612	2.2006
C2	2.1749		1.5164	1.5491	2.6126	3.0874	1.0889	2.7704	1.0909	3.5619	2.9462	2.2612	2.2006
C3	1.5164	1.5164		2.1255	1.3205	2.2354	2.2354	2.1783	2.1783	2.0997	2.0997	3.0374	2.7206
C4	1.5491	1.5491	2.1255		3.4176	2.2692	2.2692	2.2071	2.2071	4.0826	4.0826	1.0877	1.0881
C5	2.6126	2.6126	1.3205	3.4176		3.0012	3.0012	3.1550	3.1550	1.0813	1.0813	4.3575	3.8582
H6	1.0889	3.0874	2.2354	2.2692	3.0012		3.8377	1.7692	3.8175	3.0179	4.0221	2.9787	2.4857
H7	3.0874	1.0889	2.2354	2.2692	3.0012	3.8377		3.8175	1.7692	4.0221	3.0179	2.9787	2.4857
H8	1.0909	2.7704	2.1783	2.2071	3.1550	1.7692	3.8175		2.9818	3.3705	4.1053	2.4836	3.0612
H9	2.7704	1.0909	2.1783	2.2071	3.1550	3.8175	1.7692	2.9818		4.1053	3.3705	2.4836	3.0612
H10	2.9462	3.5619	2.0997	4.0826	1.0813	3.0179	4.0221	3.3705	4.1053		1.8423	5.0091	4.4731
H11	3.5619	2.9462	2.0997	4.0826	1.0813	4.0221	3.0179	4.1053	3.3705	1.8423		5.0091	4.4731
H12	2.2612	2.2612	3.0374	1.0877	4.3575	2.9787	2.9787	2.4836	2.4836	5.0091	5.0091		1.7688
H13	2.2006	2.2006	2.7206	1.0881	3.8582	2.4857	2.4857	3.0612	3.0612	4.4731	4.4731	1.7688

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C2	91.631	C1	C3	C5	134.003
C1	C4	C2	89.174	C1	C4	H12	117.006
C1	C4	H13	111.926	C2	C3	C5	134.003
C2	C4	H12	117.006	C2	C4	H13	111.926
C3	C1	C4	87.784	C3	C1	H6	117.245
C3	C1	H8	112.294	C3	C2	C4	87.784
C3	C2	H7	117.245	C3	C2	H9	112.294
C3	C5	H10	121.584	C3	C5	H11	121.584
C4	C1	H6	117.614	C4	C1	H8	112.284
C4	C2	H7	117.614	C4	C2	H9	112.284
H6	C1	H8	108.509	H7	C2	H9	108.509
H10	C5	H11	116.832	H12	C4	H13	108.765

All results from a given calculation for C₅H₈ (Cyclobutane, methylene-)

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 C5H8 (Cyclobutane, methylene-)

using model chemistry: CID/6-31G*

States and conformations

All results from a given calculation for C₅H₈ (Cyclobutane, methylene-)