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	hartrees
Energy at 0K	-117.283539
Energy at 298.15K	-117.290024
HF Energy	-117.006958
Nuclear repulsion energy	75.187264

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3216	3007	0.00
2	A₁'	1598	1494	0.00
3	A₁'	1246	1165	0.00
4	A₁"	1219	1140	0.00
5	A₂'	1203	1125	0.00
6	A₂"	3299	3085	44.59
7	A₂"	901	843	0.37
8	E'	3198	2991	22.00
8	E'	3198	2991	22.00
9	E'	1565	1463	1.70
9	E'	1565	1463	1.70
10	E'	1179	1103	12.31
10	E'	1179	1103	12.31
11	E'	912	853	22.65
11	E'	912	853	22.65
12	E"	3277	3065	0.00
12	E"	3277	3065	0.00
13	E"	1280	1197	0.00
13	E"	1280	1197	0.00
14	E"	807	755	0.00
14	E"	807	755	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	1.473	0.908
H5	1.275	-0.736	0.908
H6	-1.275	-0.736	0.908
H7	0.000	1.473	-0.908
H8	1.275	-0.736	-0.908
H9	-1.275	-0.736	-0.908

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5214	1.5214	1.0855	2.2492	2.2492	1.0855	2.2492	2.2492
C2	1.5214		1.5214	2.2492	1.0855	2.2492	2.2492	1.0855	2.2492
C3	1.5214	1.5214		2.2492	2.2492	1.0855	2.2492	2.2492	1.0855
H4	1.0855	2.2492	2.2492		2.5507	2.5507	1.8167	3.1316	3.1316
H5	2.2492	1.0855	2.2492	2.5507		2.5507	3.1316	1.8167	3.1316
H6	2.2492	2.2492	1.0855	2.5507	2.5507		3.1316	3.1316	1.8167
H7	1.0855	2.2492	2.2492	1.8167	3.1316	3.1316		2.5507	2.5507
H8	2.2492	1.0855	2.2492	3.1316	1.8167	3.1316	2.5507		2.5507
H9	2.2492	2.2492	1.0855	3.1316	3.1316	1.8167	2.5507	2.5507

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.303
C1	C2	H8	118.303	C1	C3	C2	60.000
C1	C3	H6	118.303	C1	C3	H9	118.303
C2	C1	C3	60.000	C2	C1	H4	118.303
C2	C1	H7	118.303	C2	C3	H6	118.303
C2	C3	H9	118.303	C3	C1	H4	118.303
C3	C1	H7	118.303	C3	C2	H5	118.303
C3	C2	H8	118.303	H4	C1	H7	113.611
H5	C2	H8	113.611	H6	C3	H9	113.611

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CID/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: CID/6-31G

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)