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	hartrees
Energy at 0K	-194.635754
Energy at 298.15K	-194.644243
HF Energy	-193.941187
Nuclear repulsion energy	167.150013

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3167	3016	8.45
2	A'	3151	3001	48.16
3	A'	3123	2974	15.91
4	A'	3095	2948	37.02
5	A'	3074	2927	10.14
6	A'	1785	1700	11.15
7	A'	1556	1481	0.02
8	A'	1527	1455	1.67
9	A'	1476	1405	0.68
10	A'	1300	1238	0.11
11	A'	1248	1189	0.01
12	A'	1120	1067	0.34
13	A'	998	950	0.44
14	A'	912	869	0.13
15	A'	893	850	41.12
16	A'	767	730	1.34
17	A'	675	643	1.17
18	A'	376	358	4.39
19	A'	103	98	0.03
20	A"	3247	3092	14.24
21	A"	3127	2978	15.45
22	A"	3070	2924	42.48
23	A"	1519	1447	2.23
24	A"	1321	1258	0.16
25	A"	1278	1217	0.22
26	A"	1248	1188	1.03
27	A"	1224	1166	1.72
28	A"	1066	1015	0.09
29	A"	959	913	1.20
30	A"	932	887	0.78
31	A"	833	793	0.12
32	A"	659	628	0.10
33	A"	355	338	0.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.175	-0.426	1.094
C2	0.175	-0.426	-1.094
C3	0.000	0.620	0.000
C4	-0.033	-1.515	0.000
C5	-0.320	1.915	0.000
H6	-0.535	-0.404	1.929
H7	-0.535	-0.404	-1.929
H8	1.195	-0.436	1.505
H9	1.195	-0.436	-1.505
H10	-0.458	2.469	0.928
H11	-0.458	2.469	-0.928
H12	0.664	-2.360	0.000
H13	-1.058	-1.904	0.000

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		2.1873	1.5240	1.5571	2.6315	1.0969	3.1051	1.0990	2.7912	2.9683	3.5874	2.2748	2.2134
C2	2.1873		1.5240	1.5571	2.6315	3.1051	1.0969	2.7912	1.0990	3.5874	2.9683	2.2748	2.2134
C3	1.5240	1.5240		2.1355	1.3339	2.2488	2.2488	2.1927	2.1927	2.1184	2.1184	3.0537	2.7367
C4	1.5571	1.5571	2.1355		3.4422	2.2819	2.2819	2.2213	2.2213	4.1124	4.1124	1.0957	1.0961
C5	2.6315	2.6315	1.3339	3.4422		3.0245	3.0245	3.1761	3.1761	1.0891	1.0891	4.3873	3.8897
H6	1.0969	3.1051	2.2488	2.2819	3.0245		3.8579	1.7814	3.8450	3.0434	4.0522	2.9977	2.4985
H7	3.1051	1.0969	2.2488	2.2819	3.0245	3.8579		3.8450	1.7814	4.0522	3.0434	2.9977	2.4985
H8	1.0990	2.7912	2.1927	2.2213	3.1761	1.7814	3.8450		3.0096	3.3917	4.1338	2.4994	3.0806
H9	2.7912	1.0990	2.1927	2.2213	3.1761	3.8450	1.7814	3.0096		4.1338	3.3917	2.4994	3.0806
H10	2.9683	3.5874	2.1184	4.1124	1.0891	3.0434	4.0522	3.3917	4.1338		1.8554	5.0438	4.5099
H11	3.5874	2.9683	2.1184	4.1124	1.0891	4.0522	3.0434	4.1338	3.3917	1.8554		5.0438	4.5099
H12	2.2748	2.2748	3.0537	1.0957	4.3873	2.9977	2.9977	2.4994	2.4994	5.0438	5.0438		1.7815
H13	2.2134	2.2134	2.7367	1.0961	3.8897	2.4985	2.4985	3.0806	3.0806	4.5099	4.5099	1.7815

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C2	91.721	C1	C3	C5	133.979
C1	C4	C2	89.239	C1	C4	H12	117.015
C1	C4	H13	111.903	C2	C3	C5	133.979
C2	C4	H12	117.015	C2	C4	H13	111.903
C3	C1	C4	87.748	C3	C1	H6	117.257
C3	C1	H8	112.421	C3	C2	C4	87.748
C3	C2	H7	117.257	C3	C2	H9	112.421
C3	C5	H10	121.592	C3	C5	H11	121.592
C4	C1	H6	117.537	C4	C1	H8	112.363
C4	C2	H7	117.537	C4	C2	H9	112.363
H6	C1	H8	108.431	H7	C2	H9	108.431
H10	C5	H11	116.817	H12	C4	H13	108.739

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

using model chemistry: QCISD/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: QCISD/6-31G*

States and conformations

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