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	hartrees
Energy at 0K	-117.524382
Energy at 298.15K	-117.530854
HF Energy	-117.097162
Nuclear repulsion energy	76.178070

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3244	3244	0.00
2	A₁'	1592	1592	0.00
3	A₁'	1259	1259	0.00
4	A₁"	1218	1218	0.00
5	A₂'	1160	1160	0.00
6	A₂"	3336	3336	33.83
7	A₂"	893	893	0.02
8	E'	3232	3232	22.25
8	E'	3232	3232	22.25
9	E'	1535	1535	0.64
9	E'	1535	1535	0.64
10	E'	1135	1135	7.22
10	E'	1135	1135	7.22
11	E'	927	927	23.67
11	E'	927	927	23.67
12	E"	3316	3316	0.00
12	E"	3316	3316	0.00
13	E"	1270	1270	0.00
13	E"	1270	1270	0.00
14	E"	784	784	0.00
14	E"	784	784	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.865	0.000
C2	0.749	-0.433	0.000
C3	-0.749	-0.433	0.000
H4	0.000	1.447	0.906
H5	1.253	-0.723	0.906
H6	-1.253	-0.723	0.906
H7	0.000	1.447	-0.906
H8	1.253	-0.723	-0.906
H9	-1.253	-0.723	-0.906

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.4988	1.4988	1.0768	2.2171	2.2171	1.0768	2.2171	2.2171
C2	1.4988		1.4988	2.2171	1.0768	2.2171	2.2171	1.0768	2.2171
C3	1.4988	1.4988		2.2171	2.2171	1.0768	2.2171	2.2171	1.0768
H4	1.0768	2.2171	2.2171		2.5061	2.5061	1.8125	3.0928	3.0928
H5	2.2171	1.0768	2.2171	2.5061		2.5061	3.0928	1.8125	3.0928
H6	2.2171	2.2171	1.0768	2.5061	2.5061		3.0928	3.0928	1.8125
H7	1.0768	2.2171	2.2171	1.8125	3.0928	3.0928		2.5061	2.5061
H8	2.2171	1.0768	2.2171	3.0928	1.8125	3.0928	2.5061		2.5061
H9	2.2171	2.2171	1.0768	3.0928	3.0928	1.8125	2.5061	2.5061

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.887
C1	C2	H8	117.887	C1	C3	C2	60.000
C1	C3	H6	117.887	C1	C3	H9	117.887
C2	C1	C3	60.000	C2	C1	H4	117.887
C2	C1	H7	117.887	C2	C3	H6	117.887
C2	C3	H9	117.887	C3	C1	H4	117.887
C3	C1	H7	117.887	C3	C2	H5	117.887
C3	C2	H8	117.887	H4	C1	H7	114.620
H5	C2	H8	114.620	H6	C3	H9	114.620

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CISD/TZVP

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: CISD/TZVP

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)