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	hartrees
Energy at 0K	-117.568659
Energy at 298.15K	-117.575068
HF Energy	-117.070820
Nuclear repulsion energy	75.688739

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁'	3203	3203
2	A₁'	1570	1570
3	A₁'	1233	1233
4	A₁"	1188	1188
5	A₂'	1114	1114
6	A₂"	3297	3297
7	A₂"	874	874
8	E'	3192	3192
8	E'	3192	3192
9	E'	1515	1515
9	E'	1514	1514
10	E'	1108	1108
10	E'	1108	1108
11	E'	903	903
11	E'	903	903
12	E"	3278	3278
12	E"	3278	3278
13	E"	1241	1241
13	E"	1241	1241
14	E"	765	765
14	E"	765	765

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	1.457	0.910
H5	1.262	-0.729	0.910
H6	-1.262	-0.729	0.910
H7	0.000	1.457	-0.910
H8	1.262	-0.729	-0.910
H9	-1.262	-0.729	-0.910

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5096	1.5096	1.0821	2.2319	2.2319	1.0821	2.2319	2.2319
C2	1.5096		1.5096	2.2319	1.0821	2.2319	2.2319	1.0821	2.2319
C3	1.5096	1.5096		2.2319	2.2319	1.0821	2.2319	2.2319	1.0821
H4	1.0821	2.2319	2.2319		2.5241	2.5241	1.8197	3.1116	3.1116
H5	2.2319	1.0821	2.2319	2.5241		2.5241	3.1116	1.8197	3.1116
H6	2.2319	2.2319	1.0821	2.5241	2.5241		3.1116	3.1116	1.8197
H7	1.0821	2.2319	2.2319	1.8197	3.1116	3.1116		2.5241	2.5241
H8	2.2319	1.0821	2.2319	3.1116	1.8197	3.1116	2.5241		2.5241
H9	2.2319	2.2319	1.0821	3.1116	3.1116	1.8197	2.5241	2.5241

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.954
C1	C2	H8	117.954	C1	C3	C2	60.000
C1	C3	H6	117.954	C1	C3	H9	117.954
C2	C1	C3	60.000	C2	C1	H4	117.954
C2	C1	H7	117.954	C2	C3	H6	117.954
C2	C3	H9	117.954	C3	C1	H4	117.954
C3	C1	H7	117.954	C3	C2	H5	117.954
C3	C2	H8	117.954	H4	C1	H7	114.459
H5	C2	H8	114.459	H6	C3	H9	114.459

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD(T)=FULL/6-31+G**

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/6-31+G**

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)