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	hartrees
Energy at 0K	-117.516831
Energy at 298.15K	-117.523293
HF Energy	-117.088372
Nuclear repulsion energy	75.918339

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3234	3234	0.00
2	A₁'	1590	1590	0.00
3	A₁'	1263	1263	0.00
4	A₁"	1208	1208	0.00
5	A₂'	1145	1145	0.00
6	A₂"	3326	3326	36.72
7	A₂"	889	889	0.07
8	E'	3221	3221	22.04
8	E'	3221	3221	22.04
9	E'	1528	1528	1.07
9	E'	1528	1528	1.07
10	E'	1125	1125	7.07
10	E'	1125	1125	7.07
11	E'	933	933	22.22
11	E'	933	933	22.22
12	E"	3305	3305	0.00
12	E"	3305	3305	0.00
13	E"	1265	1265	0.00
13	E"	1265	1265	0.00
14	E"	776	776	0.00
14	E"	776	776	0.00

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	1.452	0.909
H5	1.257	-0.726	0.909
H6	-1.257	-0.726	0.909
H7	0.000	1.452	-0.909
H8	1.257	-0.726	-0.909
H9	-1.257	-0.726	-0.909

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5042	1.5042	1.0800	2.2247	2.2247	1.0800	2.2247	2.2247
C2	1.5042		1.5042	2.2247	1.0800	2.2247	2.2247	1.0800	2.2247
C3	1.5042	1.5042		2.2247	2.2247	1.0800	2.2247	2.2247	1.0800
H4	1.0800	2.2247	2.2247		2.5150	2.5150	1.8176	3.1030	3.1030
H5	2.2247	1.0800	2.2247	2.5150		2.5150	3.1030	1.8176	3.1030
H6	2.2247	2.2247	1.0800	2.5150	2.5150		3.1030	3.1030	1.8176
H7	1.0800	2.2247	2.2247	1.8176	3.1030	3.1030		2.5150	2.5150
H8	2.2247	1.0800	2.2247	3.1030	1.8176	3.1030	2.5150		2.5150
H9	2.2247	2.2247	1.0800	3.1030	3.1030	1.8176	2.5150	2.5150

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.901
C1	C2	H8	117.901	C1	C3	C2	60.000
C1	C3	H6	117.901	C1	C3	H9	117.901
C2	C1	C3	60.000	C2	C1	H4	117.901
C2	C1	H7	117.901	C2	C3	H6	117.901
C2	C3	H9	117.901	C3	C1	H4	117.901
C3	C1	H7	117.901	C3	C2	H5	117.901
C3	C2	H8	117.901	H4	C1	H7	114.587
H5	C2	H8	114.586	H6	C3	H9	114.586

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CISD/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: CISD/6-311G**

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)