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	hartrees
Energy at 0K	-20.112099
Energy at 298.15K	-20.118499
HF Energy	-19.857448
Nuclear repulsion energy	42.050069

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3186	2937	0.00
2	A₁'	1561	1439	0.00
3	A₁'	1216	1121	0.00
4	A₁"	1185	1092	0.00
5	A₂'	1146	1056	0.00
6	A₂"	3283	3026	107.81
7	A₂"	871	803	2.20
8	E'	3161	2914	43.21
8	E'	3161	2914	43.21
9	E'	1506	1388	1.91
9	E'	1506	1388	1.91
10	E'	1131	1042	12.21
10	E'	1131	1042	12.21
11	E'	872	804	29.37
11	E'	872	804	29.37
12	E"	3259	3005	0.00
12	E"	3259	3005	0.00
13	E"	1235	1138	0.00
13	E"	1235	1138	0.00
14	E"	779	718	0.00
14	E"	779	718	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.900	0.000
C2	0.779	-0.450	0.000
C3	-0.779	-0.450	0.000
H4	0.000	1.493	0.924
H5	1.293	-0.747	0.924
H6	-1.293	-0.747	0.924
H7	0.000	1.493	-0.924
H8	1.293	-0.747	-0.924
H9	-1.293	-0.747	-0.924

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5586	1.5586	1.0979	2.2883	2.2883	1.0979	2.2883	2.2883
C2	1.5586		1.5586	2.2883	1.0979	2.2883	2.2883	1.0979	2.2883
C3	1.5586	1.5586		2.2883	2.2883	1.0979	2.2883	2.2883	1.0979
H4	1.0979	2.2883	2.2883		2.5863	2.5863	1.8476	3.1784	3.1784
H5	2.2883	1.0979	2.2883	2.5863		2.5863	3.1784	1.8476	3.1784
H6	2.2883	2.2883	1.0979	2.5863	2.5863		3.1784	3.1784	1.8476
H7	1.0979	2.2883	2.2883	1.8476	3.1784	3.1784		2.5863	2.5863
H8	2.2883	1.0979	2.2883	3.1784	1.8476	3.1784	2.5863		2.5863
H9	2.2883	2.2883	1.0979	3.1784	3.1784	1.8476	2.5863	2.5863

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	117.904
C1	C2	H8	117.904	C1	C3	C2	60.000
C1	C3	H6	117.904	C1	C3	H9	117.904
C2	C1	C3	60.000	C2	C1	H4	117.904
C2	C1	H7	117.904	C2	C3	H6	117.904
C2	C3	H9	117.904	C3	C1	H4	117.904
C3	C1	H7	117.904	C3	C2	H5	117.904
C3	C2	H8	117.904	H4	C1	H7	114.579
H5	C2	H8	114.579	H6	C3	H9	114.579

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CISD/CEP-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: CISD/CEP-31G

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)