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	hartrees
Energy at 0K	-576.544802
Energy at 298.15K	-576.549804
HF Energy	-575.970134
Nuclear repulsion energy	142.770946

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3257	3110
2	A	3188	3043
3	A	3167	3024
4	A	3161	3018
5	A	3101	2960
6	A	1710	1633
7	A	1527	1458
8	A	1480	1413
9	A	1347	1286
10	A	1328	1268
11	A	1255	1198
12	A	1148	1096
13	A	1012	967
14	A	968	925
15	A	926	885
16	A	925	883
17	A	776	741
18	A	607	580
19	A	406	388
20	A	290	276
21	A	104	100

Atom	x (Å)	y (Å)	z (Å)
C1	2.234	-0.181	-0.313
C2	1.128	-0.150	0.448
C3	-0.043	0.735	0.156
Cl4	-1.543	-0.235	-0.121
H5	2.329	0.430	-1.211
H6	3.079	-0.819	-0.063
H7	1.048	-0.779	1.337
H8	-0.266	1.404	0.995
H9	0.127	1.336	-0.744

	C1	C2	C3	Cl4	H5	H6	H7	H8	H9
C1		1.3431	2.4988	3.7820	1.0903	1.0883	2.1179	3.2355	2.6313
C2	1.3431		1.4969	2.7321	2.1290	2.1255	1.0915	2.1572	2.1518
C3	2.4988	1.4969		1.8077	2.7545	3.4948	2.2089	1.0956	1.0950
Cl4	3.7820	2.7321	1.8077		4.0768	4.6593	3.0222	2.3585	2.3760
H5	1.0903	2.1290	2.7545	4.0768		1.8550	3.0974	3.5419	2.4260
H6	1.0883	2.1255	3.4948	4.6593	1.8550		2.4674	4.1531	3.7177
H7	2.1179	1.0915	2.2089	3.0222	3.0974	2.4674		2.5703	3.1065
H8	3.2355	2.1572	1.0956	2.3585	3.5419	4.1531	2.5703		1.7840
H9	2.6313	2.1518	1.0950	2.3760	2.4260	3.7177	3.1065	1.7840

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.159	C1	C2	H7	120.550
C2	C1	H5	121.720	C2	C1	H6	121.545
C2	C3	Cl4	111.191	C2	C3	H8	111.694
C2	C3	H9	111.302	C3	C2	H7	116.289
Cl4	C3	H8	106.039	Cl4	C3	H9	107.324
H5	C1	H6	116.735	H8	C3	H9	109.057

All results from a given calculation for C₃H₅Cl (1-Propene, 3-chloro-)

using model chemistry: MP4/6-31G*

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 C3H5Cl (1-Propene, 3-chloro-)

using model chemistry: MP4/6-31G*

States and conformations

All results from a given calculation for C₃H₅Cl (1-Propene, 3-chloro-)