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	hartrees
Energy at 0K	-117.544252
Energy at 298.15K	-117.550604
HF Energy	-117.070317
Nuclear repulsion energy	75.104254

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3185	3185	0.00
2	A₁'	1529	1529	0.00
3	A₁'	1222	1222	0.00
4	A₁"	1150	1150	0.00
5	A₂'	1069	1069	0.00
6	A₂"	3281	3281	30.61
7	A₂"	850	850	0.16
8	E'	3173	3173	20.19
8	E'	3173	3173	20.19
9	E'	1472	1472	0.38
9	E'	1472	1472	0.38
10	E'	1048	1048	6.83
10	E'	1048	1048	6.83
11	E'	895	895	19.94
11	E'	895	895	19.94
12	E"	3261	3261	0.00
12	E"	3261	3261	0.00
13	E"	1209	1209	0.00
13	E"	1209	1209	0.00
14	E"	733	733	0.00
14	E"	733	733	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.878	0.000
C2	0.761	-0.439	0.000
C3	-0.761	-0.439	0.000
H4	0.000	1.465	0.920
H5	1.269	-0.733	0.920
H6	-1.269	-0.733	0.920
H7	0.000	1.465	-0.920
H8	1.269	-0.733	-0.920
H9	-1.269	-0.733	-0.920

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5211	1.5211	1.0915	2.2477	2.2477	1.0915	2.2477	2.2477
C2	1.5211		1.5211	2.2477	1.0915	2.2477	2.2477	1.0915	2.2477
C3	1.5211	1.5211		2.2477	2.2477	1.0915	2.2477	2.2477	1.0915
H4	1.0915	2.2477	2.2477		2.5383	2.5383	1.8400	3.1350	3.1350
H5	2.2477	1.0915	2.2477	2.5383		2.5383	3.1350	1.8400	3.1350
H6	2.2477	2.2477	1.0915	2.5383	2.5383		3.1350	3.1350	1.8400
H7	1.0915	2.2477	2.2477	1.8400	3.1350	3.1350		2.5383	2.5383
H8	2.2477	1.0915	2.2477	3.1350	1.8400	3.1350	2.5383		2.5383
H9	2.2477	2.2477	1.0915	3.1350	3.1350	1.8400	2.5383	2.5383

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.774
C1	C2	H8	117.774	C1	C3	C2	60.000
C1	C3	H6	117.774	C1	C3	H9	117.774
C2	C1	C3	60.000	C2	C1	H4	117.774
C2	C1	H7	117.774	C2	C3	H6	117.774
C2	C3	H9	117.774	C3	C1	H4	117.774
C3	C1	H7	117.774	C3	C2	H5	117.774
C3	C2	H8	117.774	H4	C1	H7	114.896
H5	C2	H8	114.896	H6	C3	H9	114.896

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: MP3/aug-cc-pVDZ

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: MP3/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)