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	hartrees
Energy at 0K	-117.526177
Energy at 298.15K	-117.532574
HF Energy	-117.077568
Nuclear repulsion energy	75.518496

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3154	3007	0.00
2	A₁'	1557	1485	0.00
3	A₁'	1235	1178	0.00
4	A₁"	1179	1124	0.00
5	A₂'	1100	1049	0.00
6	A₂"	3244	3093	40.65
7	A₂"	865	825	0.29
8	E'	3142	2996	24.17
8	E'	3142	2996	24.17
9	E'	1500	1430	2.18
9	E'	1500	1430	2.18
10	E'	1090	1039	10.18
10	E'	1090	1039	10.18
11	E'	908	866	21.48
11	E'	908	866	21.48
12	E"	3224	3074	0.00
12	E"	3224	3074	0.00
13	E"	1236	1178	0.00
13	E"	1236	1178	0.00
14	E"	761	726	0.00
14	E"	761	726	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.873	0.000
C2	0.756	-0.436	0.000
C3	-0.756	-0.436	0.000
H4	0.000	1.461	0.914
H5	1.265	-0.730	0.914
H6	-1.265	-0.730	0.914
H7	0.000	1.461	-0.914
H8	1.265	-0.730	-0.914
H9	-1.265	-0.730	-0.914

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5113	1.5113	1.0867	2.2372	2.2372	1.0867	2.2372	2.2372
C2	1.5113		1.5113	2.2372	1.0867	2.2372	2.2372	1.0867	2.2372
C3	1.5113	1.5113		2.2372	2.2372	1.0867	2.2372	2.2372	1.0867
H4	1.0867	2.2372	2.2372		2.5303	2.5303	1.8272	3.1211	3.1211
H5	2.2372	1.0867	2.2372	2.5303		2.5304	3.1211	1.8272	3.1211
H6	2.2372	2.2372	1.0867	2.5303	2.5304		3.1211	3.1211	1.8272
H7	1.0867	2.2372	2.2372	1.8272	3.1211	3.1211		2.5303	2.5303
H8	2.2372	1.0867	2.2372	3.1211	1.8272	3.1211	2.5303		2.5304
H9	2.2372	2.2372	1.0867	3.1211	3.1211	1.8272	2.5303	2.5304

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.962
C1	C2	H8	117.962	C1	C3	C2	60.000
C1	C3	H6	117.962	C1	C3	H9	117.962
C2	C1	C3	60.000	C2	C1	H4	117.962
C2	C1	H7	117.962	C2	C3	H6	117.962
C2	C3	H9	117.962	C3	C1	H4	117.962
C3	C1	H7	117.962	C3	C2	H5	117.962
C3	C2	H8	117.962	H4	C1	H7	114.439
H5	C2	H8	114.438	H6	C3	H9	114.438

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CCSD/6-311G*

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: CCSD/6-311G*

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)