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	hartrees
Energy at 0K	-20.100732
Energy at 298.15K
HF Energy	-19.856354
Nuclear repulsion energy	41.904038

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁'	3160	3054	0.00	270.70	0.05	0.10
2	A₁'	1541	1489	0.00	14.01	0.39	0.56
3	A₁'	1194	1154	0.00	41.72	0.09	0.16
4	A₁"	1179	1139	0.00	0.00	0.75	0.86
5	A₂'	1123	1085	0.00	0.00	0.00	0.00
6	A₂"	3276	3165	88.44	0.00	0.00	0.00
7	A₂"	872	842	2.87	0.00	0.00	0.00
8	E'	3145	3039	36.99	18.14	0.75	0.86
8	E'	3145	3039	36.99	18.14	0.75	0.86
9	E'	1495	1445	1.73	4.38	0.75	0.86
9	E'	1495	1445	1.73	4.38	0.75	0.86
10	E'	1115	1078	16.74	1.15	0.75	0.86
10	E'	1115	1078	16.74	1.15	0.75	0.86
11	E'	851	822	26.87	20.36	0.75	0.86
11	E'	851	822	26.87	20.36	0.75	0.86
12	E"	3253	3143	0.00	72.70	0.75	0.86
12	E"	3253	3143	0.00	72.70	0.75	0.86
13	E"	1224	1182	0.00	10.13	0.75	0.86
13	E"	1224	1182	0.00	10.13	0.75	0.86
14	E"	775	749	0.00	1.08	0.75	0.86
14	E"	775	749	0.00	1.08	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.904	0.000
C2	0.783	-0.452	0.000
C3	-0.783	-0.452	0.000
H4	0.000	1.497	0.927
H5	1.296	-0.748	0.927
H6	-1.296	-0.748	0.927
H7	0.000	1.497	-0.927
H8	1.296	-0.748	-0.927
H9	-1.296	-0.748	-0.927

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5658	1.5658	1.1005	2.2956	2.2956	1.1005	2.2956	2.2956
C2	1.5658		1.5658	2.2956	1.1005	2.2956	2.2956	1.1005	2.2956
C3	1.5658	1.5658		2.2956	2.2956	1.1005	2.2956	2.2956	1.1005
H4	1.1005	2.2956	2.2956		2.5922	2.5922	1.8547	3.1874	3.1874
H5	2.2956	1.1005	2.2956	2.5922		2.5922	3.1874	1.8547	3.1874
H6	2.2956	2.2956	1.1005	2.5922	2.5922		3.1874	3.1874	1.8547
H7	1.1005	2.2956	2.2956	1.8547	3.1874	3.1874		2.5922	2.5922
H8	2.2956	1.1005	2.2956	3.1874	1.8547	3.1874	2.5922		2.5922
H9	2.2956	2.2956	1.1005	3.1874	3.1874	1.8547	2.5922	2.5922

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.796
C1	C2	H8	117.796	C1	C3	C2	60.000
C1	C3	H6	117.796	C1	C3	H9	117.796
C2	C1	C3	60.000	C2	C1	H4	117.796
C2	C1	H7	117.796	C2	C3	H6	117.796
C2	C3	H9	117.796	C3	C1	H4	117.796
C3	C1	H7	117.796	C3	C2	H5	117.796
C3	C2	H8	117.796	H4	C1	H7	114.841
H5	C2	H8	114.841	H6	C3	H9	114.841

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: MP2/CEP-31G

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: MP2/CEP-31G

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)