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	hartrees
Energy at 0K	-116.867207
Energy at 298.15K	-116.871245
HF Energy	-116.438769
Nuclear repulsion energy	63.962086

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3265	3157
2	A'	3166	3061
3	A'	3087	2985
4	A'	3052	2951
5	A'	1861	1799
6	A'	1478	1429
7	A'	1403	1357
8	A'	1273	1231
9	A'	1130	1092
10	A'	942	911
11	A'	831	803
12	A'	403	389
13	A"	3130	3026
14	A"	1473	1424
15	A"	1083	1047
16	A"	908	878
17	A"	667	645
18	A"	198	192

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.447	0.000
C2	1.304	0.353	0.000
C3	-0.972	-0.715	0.000
H4	-0.448	1.460	0.000
H5	2.145	1.055	0.000
H6	-0.436	-1.679	0.000
H7	-1.626	-0.671	0.892
H8	-1.626	-0.671	-0.892

	C1	C2	C3	H4	H5	H6	H7	H8
C1		1.3078	1.5150	1.1081	2.2297	2.1697	2.1655	2.1655
C2	1.3078		2.5151	2.0729	1.0950	2.6756	3.2301	3.2301
C3	1.5150	2.5151		2.2372	3.5850	1.1030	1.1064	1.1064
H4	1.1081	2.0729	2.2372		2.6250	3.1388	2.5931	2.5931
H5	2.2297	1.0950	3.5850	2.6250		3.7598	4.2424	4.2424
H6	2.1697	2.6756	1.1030	3.1388	3.7598		1.7963	1.7963
H7	2.1655	3.2301	1.1064	2.5931	4.2424	1.7963		1.7832
H8	2.1655	3.2301	1.1064	2.5931	4.2424	1.7963	1.7832

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	136.060	C1	C3	H6	110.962
C1	C3	H7	110.422	C1	C3	H8	110.422
C2	C1	C3	125.843	C2	C1	H4	117.965
C3	C1	H4	116.192	H6	C3	H7	108.779
H6	C3	H8	108.779	H7	C3	H8	107.382

All results from a given calculation for CH₃CHCH (1-propenyl radical)

using model chemistry: MP4/cc-pVDZ

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 CH3CHCH (1-propenyl radical)

using model chemistry: MP4/cc-pVDZ

States and conformations

All results from a given calculation for CH₃CHCH (1-propenyl radical)