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	hartrees
Energy at 0K	-117.319521
Energy at 298.15K	-117.325880
HF Energy	-117.013396
Nuclear repulsion energy	73.800049

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3102	2926
2	A₁'	1518	1431
3	A₁'	1167	1101
4	A₁"	1166	1100
5	A₂'	1132	1068
6	A₂"	3203	3021
7	A₂"	872	822
8	E'	3087	2911
8	E'	3087	2911
9	E'	1486	1401
9	E'	1486	1401
10	E'	1123	1059
10	E'	1123	1059
11	E'	834	786
11	E'	833	786
12	E"	3182	3001
12	E"	3182	3001
13	E"	1220	1151
13	E"	1220	1151
14	E"	780	735
14	E"	779	735

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.899	0.000
C2	0.779	-0.449	0.000
C3	-0.779	-0.449	0.000
H4	0.000	1.493	0.923
H5	1.293	-0.747	0.923
H6	-1.293	-0.747	0.923
H7	0.000	1.493	-0.923
H8	1.293	-0.747	-0.923
H9	-1.293	-0.747	-0.923

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5571	1.5571	1.0980	2.2874	2.2874	1.0980	2.2874	2.2874
C2	1.5571		1.5571	2.2874	1.0980	2.2874	2.2874	1.0980	2.2874
C3	1.5571	1.5571		2.2874	2.2874	1.0980	2.2874	2.2874	1.0980
H4	1.0980	2.2874	2.2874		2.5861	2.5861	1.8467	3.1778	3.1778
H5	2.2874	1.0980	2.2874	2.5861		2.5861	3.1778	1.8467	3.1778
H6	2.2874	2.2874	1.0980	2.5861	2.5861		3.1778	3.1778	1.8467
H7	1.0980	2.2874	2.2874	1.8467	3.1778	3.1778		2.5861	2.5861
H8	2.2874	1.0980	2.2874	3.1778	1.8467	3.1778	2.5861		2.5861
H9	2.2874	2.2874	1.0980	3.1778	3.1778	1.8467	2.5861	2.5861

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.943
C1	C2	H8	117.943	C1	C3	C2	60.000
C1	C3	H6	117.943	C1	C3	H9	117.943
C2	C1	C3	60.000	C2	C1	H4	117.943
C2	C1	H7	117.943	C2	C3	H6	117.943
C2	C3	H9	117.943	C3	C1	H4	117.943
C3	C1	H7	117.943	C3	C2	H5	117.943
C3	C2	H8	117.943	H4	C1	H7	114.485
H5	C2	H8	114.485	H6	C3	H9	114.485

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD(T)/LANL2DZ

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)/LANL2DZ

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)