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	hartrees
Energy at 0K	-117.491231
Energy at 298.15K
HF Energy	-117.066492
Nuclear repulsion energy	75.279984

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'	3198	3046	0.00	260.27	0.04	0.08
2	A₁'	1527	1455	0.00	3.61	0.62	0.76
3	A₁'	1240	1181	0.00	30.82	0.09	0.16
4	A₁"	1160	1105	0.00	0.00	0.75	0.86
5	A₂'	1075	1024	0.00	0.00	0.00	0.00
6	A₂"	3304	3147	18.38	0.00	0.75	0.86
7	A₂"	861	820	0.37	0.00	0.75	0.86
8	E'	3187	3036	14.74	19.88	0.75	0.86
8	E'	3187	3036	14.74	19.88	0.75	0.86
9	E'	1464	1395	0.79	7.42	0.75	0.86
9	E'	1464	1395	0.79	7.42	0.75	0.86
10	E'	1059	1009	7.80	0.47	0.75	0.86
10	E'	1059	1009	7.80	0.47	0.75	0.86
11	E'	915	872	18.18	13.43	0.75	0.86
11	E'	915	872	18.18	13.43	0.75	0.86
12	E"	3286	3130	0.00	95.85	0.75	0.86
12	E"	3286	3130	0.00	95.85	0.75	0.86
13	E"	1211	1153	0.00	8.19	0.75	0.86
13	E"	1211	1153	0.00	8.19	0.75	0.86
14	E"	737	702	0.00	1.99	0.75	0.86
14	E"	737	702	0.00	1.99	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.874	0.000
C2	0.757	-0.437	0.000
C3	-0.757	-0.437	0.000
H4	0.000	1.463	0.921
H5	1.267	-0.731	0.921
H6	-1.267	-0.731	0.921
H7	0.000	1.463	-0.921
H8	1.267	-0.731	-0.921
H9	-1.267	-0.731	-0.921

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5143	1.5143	1.0932	2.2431	2.2431	1.0932	2.2431	2.2431
C2	1.5143		1.5143	2.2431	1.0932	2.2431	2.2431	1.0932	2.2431
C3	1.5143	1.5143		2.2431	2.2431	1.0932	2.2431	2.2431	1.0932
H4	1.0932	2.2431	2.2431		2.5335	2.5335	1.8427	3.1327	3.1327
H5	2.2431	1.0932	2.2431	2.5335		2.5335	3.1327	1.8427	3.1327
H6	2.2431	2.2431	1.0932	2.5335	2.5335		3.1327	3.1327	1.8427
H7	1.0932	2.2431	2.2431	1.8427	3.1327	3.1327		2.5335	2.5335
H8	2.2431	1.0932	2.2431	3.1327	1.8427	3.1327	2.5335		2.5335
H9	2.2431	2.2431	1.0932	3.1327	3.1327	1.8427	2.5335	2.5335

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.782
C1	C2	H8	117.782	C1	C3	C2	60.000
C1	C3	H6	117.782	C1	C3	H9	117.782
C2	C1	C3	60.000	C2	C1	H4	117.782
C2	C1	H7	117.782	C2	C3	H6	117.782
C2	C3	H9	117.782	C3	C1	H4	117.782
C3	C1	H7	117.782	C3	C2	H5	117.782
C3	C2	H8	117.782	H4	C1	H7	114.875
H5	C2	H8	114.875	H6	C3	H9	114.875

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: MP2/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: MP2/cc-pVDZ

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)