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	hartrees
Energy at 0K	-117.670323
Energy at 298.15K	-117.676688
HF Energy	-117.100949
Nuclear repulsion energy	75.713481

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3158	3078
2	A₁'	1528	1490
3	A₁'	1215	1184
4	A₁"	1161	1132
5	A₂'	1088	1061
6	A₂"	3249	3168
7	A₂"	856	835
8	E'	3147	3068
8	E'	3147	3068
9	E'	1478	1440
9	E'	1477	1440
10	E'	1061	1034
10	E'	1061	1034
11	E'	892	870
11	E'	892	870
12	E"	3230	3148
12	E"	3229	3148
13	E"	1217	1186
13	E"	1217	1186
14	E"	740	721
14	E"	740	721

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.872	0.000
C2	0.755	-0.436	0.000
C3	-0.755	-0.436	0.000
H4	0.000	1.454	0.911
H5	1.259	-0.727	0.911
H6	-1.259	-0.727	0.911
H7	0.000	1.454	-0.911
H8	1.259	-0.727	-0.911
H9	-1.259	-0.727	-0.911

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5099	1.5099	1.0813	2.2297	2.2297	1.0813	2.2297	2.2297
C2	1.5099		1.5099	2.2297	1.0813	2.2297	2.2297	1.0813	2.2297
C3	1.5099	1.5099		2.2297	2.2297	1.0813	2.2297	2.2297	1.0813
H4	1.0813	2.2297	2.2297		2.5183	2.5183	1.8224	3.1085	3.1085
H5	2.2297	1.0813	2.2297	2.5183		2.5183	3.1085	1.8224	3.1085
H6	2.2297	2.2297	1.0813	2.5183	2.5183		3.1085	3.1085	1.8224
H7	1.0813	2.2297	2.2297	1.8224	3.1085	3.1085		2.5183	2.5183
H8	2.2297	1.0813	2.2297	3.1085	1.8224	3.1085	2.5183		2.5183
H9	2.2297	2.2297	1.0813	3.1085	3.1085	1.8224	2.5183	2.5183

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.795
C1	C2	H8	117.795	C1	C3	C2	60.000
C1	C3	H6	117.795	C1	C3	H9	117.795
C2	C1	C3	60.000	C2	C1	H4	117.795
C2	C1	H7	117.795	C2	C3	H6	117.795
C2	C3	H9	117.795	C3	C1	H4	117.795
C3	C1	H7	117.795	C3	C2	H5	117.795
C3	C2	H8	117.795	H4	C1	H7	114.844
H5	C2	H8	114.844	H6	C3	H9	114.844

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD(T)/cc-pVTZ

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)/cc-pVTZ

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)