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	hartrees
Energy at 0K	-117.448575
Energy at 298.15K
HF Energy	-117.058470
Nuclear repulsion energy	75.816268

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'	3219	3035	0.00	214.45	0.05	0.09
2	A₁'	1587	1496	0.00	5.32	0.75	0.85
3	A₁'	1267	1195	0.00	26.01	0.09	0.16
4	A₁"	1200	1132	0.00	0.00	0.75	0.86
5	A₂'	1118	1054	0.00	0.00	0.00	0.00
6	A₂"	3314	3125	24.47	0.00	0.00	0.00
7	A₂"	889	838	0.47	0.00	0.75	0.86
8	E'	3211	3028	16.84	16.99	0.75	0.86
8	E'	3211	3028	16.84	16.99	0.75	0.86
9	E'	1532	1445	0.79	8.30	0.75	0.86
9	E'	1532	1445	0.79	8.30	0.75	0.86
10	E'	1111	1048	11.15	0.00	0.75	0.86
10	E'	1111	1048	11.15	0.00	0.75	0.86
11	E'	934	881	18.07	13.96	0.75	0.86
11	E'	934	881	18.07	13.96	0.75	0.86
12	E"	3297	3109	0.00	82.57	0.75	0.86
12	E"	3297	3109	0.00	82.57	0.75	0.86
13	E"	1254	1183	0.00	11.23	0.75	0.86
13	E"	1254	1183	0.00	11.23	0.75	0.86
14	E"	770	726	0.00	2.65	0.75	0.86
14	E"	770	726	0.00	2.65	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.868	0.000
C2	0.752	-0.434	0.000
C3	-0.752	-0.434	0.000
H4	0.000	1.457	0.911
H5	1.262	-0.728	0.911
H6	-1.262	-0.728	0.911
H7	0.000	1.457	-0.911
H8	1.262	-0.728	-0.911
H9	-1.262	-0.728	-0.911

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5035	1.5035	1.0846	2.2294	2.2294	1.0846	2.2294	2.2294
C2	1.5035		1.5035	2.2294	1.0846	2.2294	2.2294	1.0846	2.2294
C3	1.5035	1.5035		2.2294	2.2294	1.0846	2.2294	2.2294	1.0846
H4	1.0846	2.2294	2.2294		2.5235	2.5235	1.8216	3.1123	3.1123
H5	2.2294	1.0846	2.2294	2.5235		2.5235	3.1123	1.8216	3.1123
H6	2.2294	2.2294	1.0846	2.5235	2.5235		3.1123	3.1123	1.8216
H7	1.0846	2.2294	2.2294	1.8216	3.1123	3.1123		2.5235	2.5235
H8	2.2294	1.0846	2.2294	3.1123	1.8216	3.1123	2.5235		2.5235
H9	2.2294	2.2294	1.0846	3.1123	3.1123	1.8216	2.5235	2.5235

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.049
C1	C2	H8	118.049	C1	C3	C2	60.000
C1	C3	H6	118.049	C1	C3	H9	118.049
C2	C1	C3	60.000	C2	C1	H4	118.049
C2	C1	H7	118.049	C2	C3	H6	118.049
C2	C3	H9	118.049	C3	C1	H4	118.049
C3	C1	H7	118.049	C3	C2	H5	118.049
C3	C2	H8	118.049	H4	C1	H7	114.229
H5	C2	H8	114.229	H6	C3	H9	114.229

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: MP2/6-31G*

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: MP2/6-31G*

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)