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	hartrees
Energy at 0K	-117.599807
Energy at 298.15K	-117.606184
HF Energy	-117.077363
Nuclear repulsion energy	75.431416

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3137	3137
2	A₁'	1545	1545
3	A₁'	1224	1224
4	A₁"	1172	1172
5	A₂'	1085	1085
6	A₂"	3229	3229
7	A₂"	860	860
8	E'	3126	3126
8	E'	3126	3126
9	E'	1490	1490
9	E'	1490	1490
10	E'	1080	1080
10	E'	1080	1080
11	E'	898	898
11	E'	898	898
12	E"	3208	3208
12	E"	3208	3208
13	E"	1227	1227
13	E"	1227	1227
14	E"	756	756
14	E"	756	756

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.874	0.000
C2	0.757	-0.437	0.000
C3	-0.757	-0.437	0.000
H4	0.000	1.462	0.915
H5	1.266	-0.731	0.915
H6	-1.266	-0.731	0.915
H7	0.000	1.462	-0.915
H8	1.266	-0.731	-0.915
H9	-1.266	-0.731	-0.915

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5133	1.5133	1.0878	2.2395	2.2395	1.0878	2.2395	2.2395
C2	1.5133		1.5133	2.2395	1.0878	2.2395	2.2395	1.0878	2.2395
C3	1.5133	1.5133		2.2395	2.2395	1.0878	2.2395	2.2395	1.0878
H4	1.0878	2.2395	2.2395		2.5323	2.5323	1.8300	3.1243	3.1243
H5	2.2395	1.0878	2.2395	2.5323		2.5323	3.1243	1.8300	3.1243
H6	2.2395	2.2395	1.0878	2.5323	2.5323		3.1243	3.1243	1.8300
H7	1.0878	2.2395	2.2395	1.8300	3.1243	3.1243		2.5323	2.5323
H8	2.2395	1.0878	2.2395	3.1243	1.8300	3.1243	2.5323		2.5323
H9	2.2395	2.2395	1.0878	3.1243	3.1243	1.8300	2.5323	2.5323

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.928
C1	C2	H8	117.928	C1	C3	C2	60.000
C1	C3	H6	117.928	C1	C3	H9	117.928
C2	C1	C3	60.000	C2	C1	H4	117.928
C2	C1	H7	117.928	C2	C3	H6	117.928
C2	C3	H9	117.928	C3	C1	H4	117.928
C3	C1	H7	117.928	C3	C2	H5	117.928
C3	C2	H8	117.928	H4	C1	H7	114.521
H5	C2	H8	114.521	H6	C3	H9	114.521

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD(T)=FULL/6-311G*

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/6-311G*

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)