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	hartrees
Energy at 0K	-117.363123
Energy at 298.15K	-117.369484
HF Energy	-117.014052
Nuclear repulsion energy	73.828940

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3103	3103
2	A₁'	1518	1518
3	A₁'	1168	1168
4	A₁"	1166	1166
5	A₂'	1132	1132
6	A₂"	3204	3204
7	A₂"	871	871
8	E'	3087	3087
8	E'	3087	3087
9	E'	1486	1486
9	E'	1486	1486
10	E'	1123	1123
10	E'	1123	1123
11	E'	834	834
11	E'	834	834
12	E"	3182	3182
12	E"	3182	3182
13	E"	1221	1221
13	E"	1221	1221
14	E"	780	780
14	E"	779	779

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.899	0.000
C2	0.778	-0.449	0.000
C3	-0.778	-0.449	0.000
H4	0.000	1.492	0.923
H5	1.292	-0.746	0.923
H6	-1.292	-0.746	0.923
H7	0.000	1.492	-0.923
H8	1.292	-0.746	-0.923
H9	-1.292	-0.746	-0.923

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5564	1.5564	1.0977	2.2864	2.2864	1.0977	2.2864	2.2864
C2	1.5564		1.5564	2.2864	1.0977	2.2864	2.2864	1.0977	2.2864
C3	1.5564	1.5564		2.2864	2.2864	1.0977	2.2864	2.2864	1.0977
H4	1.0977	2.2864	2.2864		2.5847	2.5847	1.8466	3.1765	3.1765
H5	2.2864	1.0977	2.2864	2.5847		2.5847	3.1765	1.8466	3.1765
H6	2.2864	2.2864	1.0977	2.5847	2.5847		3.1765	3.1765	1.8466
H7	1.0977	2.2864	2.2864	1.8466	3.1765	3.1765		2.5847	2.5847
H8	2.2864	1.0977	2.2864	3.1765	1.8466	3.1765	2.5847		2.5847
H9	2.2864	2.2864	1.0977	3.1765	3.1765	1.8466	2.5847	2.5847

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.930
C1	C2	H8	117.930	C1	C3	C2	60.000
C1	C3	H6	117.930	C1	C3	H9	117.930
C2	C1	C3	60.000	C2	C1	H4	117.930
C2	C1	H7	117.930	C2	C3	H6	117.930
C2	C3	H9	117.930	C3	C1	H4	117.930
C3	C1	H7	117.930	C3	C2	H5	117.930
C3	C2	H8	117.930	H4	C1	H7	114.517
H5	C2	H8	114.517	H6	C3	H9	114.517

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD(T)=FULL/SDD

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/SDD

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)