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	hartrees
Energy at 0K	-117.282483
Energy at 298.15K	-117.288918
HF Energy	-117.016009
Nuclear repulsion energy	74.402055

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁'	3194	2951	0.00
2	A₁'	1564	1445	0.00
3	A₁'	1219	1126	0.00
4	A₁"	1197	1106	0.00
5	A₂'	1179	1089	0.00
6	A₂"	3290	3040	63.08
7	A₂"	892	824	2.53
8	E'	3172	2931	32.21
8	E'	3172	2931	32.21
9	E'	1526	1410	3.30
9	E'	1526	1410	3.30
10	E'	1153	1065	14.27
10	E'	1153	1065	14.27
11	E'	879	812	26.85
11	E'	879	812	26.85
12	E"	3268	3020	0.00
12	E"	3268	3020	0.00
13	E"	1255	1159	0.00
13	E"	1255	1159	0.00
14	E"	798	738	0.00
14	E"	798	738	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.891	0.000
C2	0.772	-0.446	0.000
C3	-0.772	-0.446	0.000
H4	0.000	1.483	0.915
H5	1.284	-0.741	0.915
H6	-1.284	-0.741	0.915
H7	0.000	1.483	-0.915
H8	1.284	-0.741	-0.915
H9	-1.284	-0.741	-0.915

	C1	C2	C3	H4	H5	H6	H7	H8	H9
C1		1.5433	1.5433	1.0902	2.2699	2.2699	1.0902	2.2699	2.2699
C2	1.5433		1.5433	2.2699	1.0902	2.2699	2.2699	1.0902	2.2699
C3	1.5433	1.5433		2.2699	2.2699	1.0902	2.2699	2.2699	1.0902
H4	1.0902	2.2699	2.2699		2.5685	2.5685	1.8310	3.1543	3.1543
H5	2.2699	1.0902	2.2699	2.5685		2.5685	3.1543	1.8310	3.1543
H6	2.2699	2.2699	1.0902	2.5685	2.5685		3.1543	3.1543	1.8310
H7	1.0902	2.2699	2.2699	1.8310	3.1543	3.1543		2.5685	2.5685
H8	2.2699	1.0902	2.2699	3.1543	1.8310	3.1543	2.5685		2.5685
H9	2.2699	2.2699	1.0902	3.1543	3.1543	1.8310	2.5685	2.5685

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	60.000	C1	C2	H5	118.049
C1	C2	H8	118.049	C1	C3	C2	60.000
C1	C3	H6	118.049	C1	C3	H9	118.049
C2	C1	C3	60.000	C2	C1	H4	118.049
C2	C1	H7	118.049	C2	C3	H6	118.049
C2	C3	H9	118.049	C3	C1	H4	118.049
C3	C1	H7	118.049	C3	C2	H5	118.049
C3	C2	H8	118.049	H4	C1	H7	114.227
H5	C2	H8	114.227	H6	C3	H9	114.227

All results from a given calculation for C₃H₆ (Cyclopropane)

using model chemistry: CID/LANL2DZ

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/LANL2DZ

States and conformations

All results from a given calculation for C₃H₆ (Cyclopropane)