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	hartrees
Energy at 0K	-20.146021
Energy at 298.15K	-20.152348
HF Energy	-19.854567
Nuclear repulsion energy	41.720450

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3096	3096
2	A₁'	1515	1515
3	A₁'	1169	1169
4	A₁"	1154	1154
5	A₂'	1102	1102
6	A₂"	3201	3201
7	A₂"	851	851
8	E'	3079	3079
8	E'	3079	3079
9	E'	1467	1467
9	E'	1467	1467
10	E'	1101	1101
10	E'	1101	1101
11	E'	832	832
11	E'	832	832
12	E"	3178	3178
12	E"	3178	3178
13	E"	1202	1202
13	E"	1202	1202
14	E"	760	760
14	E"	760	760

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.908	0.000
C2	0.786	-0.454	0.000
C3	-0.786	-0.454	0.000
H4	0.000	1.504	0.932
H5	1.302	-0.752	0.932
H6	-1.302	-0.752	0.932
H7	0.000	1.504	-0.932
H8	1.302	-0.752	-0.932
H9	-1.302	-0.752	-0.932

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5722	1.5722	1.1060	2.3061	2.3061	1.1060	2.3061	2.3061
C2	1.5722		1.5722	2.3061	1.1060	2.3061	2.3061	1.1060	2.3061
C3	1.5722	1.5722		2.3061	2.3061	1.1060	2.3061	2.3061	1.1060
H4	1.1060	2.3061	2.3061		2.6044	2.6044	1.8634	3.2024	3.2024
H5	2.3061	1.1060	2.3061	2.6044		2.6044	3.2024	1.8634	3.2024
H6	2.3061	2.3061	1.1060	2.6044	2.6044		3.2024	3.2024	1.8634
H7	1.1060	2.3061	2.3061	1.8634	3.2024	3.2024		2.6044	2.6044
H8	2.3061	1.1060	2.3061	3.2024	1.8634	3.2024	2.6044		2.6044
H9	2.3061	2.3061	1.1060	3.2024	3.2024	1.8634	2.6044	2.6044

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.817
C1	C2	H8	117.817	C1	C3	C2	60.000
C1	C3	H6	117.817	C1	C3	H9	117.817
C2	C1	C3	60.000	C2	C1	H4	117.817
C2	C1	H7	117.817	C2	C3	H6	117.817
C2	C3	H9	117.817	C3	C1	H4	117.817
C3	C1	H7	117.817	C3	C2	H5	117.817
C3	C2	H8	117.817	H4	C1	H7	114.790
H5	C2	H8	114.790	H6	C3	H9	114.790

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD(T)=FULL/CEP-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 C3H6 (Cyclopropane)

using model chemistry: CCSD(T)=FULL/CEP-31G

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)