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	hartrees
Energy at 0K	-576.549230
Energy at 298.15K	-576.554063
HF Energy	-575.971603
Nuclear repulsion energy	145.060073

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3242	3095
2	A'	3176	3033
3	A'	3164	3021
4	A'	3059	2920
5	A'	1703	1626
6	A'	1532	1463
7	A'	1461	1395
8	A'	1387	1324
9	A'	1283	1225
10	A'	1121	1070
11	A'	961	918
12	A'	778	743
13	A'	568	543
14	A'	231	221
15	A"	3122	2981
16	A"	1533	1463
17	A"	1086	1037
18	A"	928	886
19	A"	713	681
20	A"	394	376
21	A"	100	95

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.920	0.000
C2	-1.248	0.427	0.000
C3	-1.658	-1.016	0.000
Cl4	1.447	-0.057	0.000
H5	0.217	1.984	0.000
H6	-2.048	1.172	0.000
H7	-0.787	-1.679	0.000
H8	-2.269	-1.243	0.885
H9	-2.269	-1.243	-0.885

	C1	C2	C3	Cl4	H5	H6	H7	H8	H9
C1		1.3421	2.5490	1.7456	1.0866	2.0630	2.7158	3.2573	3.2573
C2	1.3421		1.5004	2.7382	2.1383	1.0923	2.1564	2.1482	2.1482
C3	2.5490	1.5004		3.2496	3.5384	2.2224	1.0945	1.0988	1.0988
Cl4	1.7456	2.7382	3.2496		2.3834	3.7040	2.7609	3.9996	3.9996
H5	1.0866	2.1383	3.5384	2.3834		2.4059	3.7990	4.1691	4.1691
H6	2.0630	1.0923	2.2224	3.7040	2.4059		3.1172	2.5815	2.5815
H7	2.7158	2.1564	1.0945	2.7609	3.7990	3.1172		1.7800	1.7800
H8	3.2573	2.1482	1.0988	3.9996	4.1691	2.5815	1.7800		1.7693
H9	3.2573	2.1482	1.0988	3.9996	4.1691	2.5815	1.7800	1.7693

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	127.382	C1	C2	H6	115.488
C2	C1	Cl4	124.437	C2	C1	H5	123.048
C2	C3	H7	111.443	C2	C3	H8	110.526
C2	C3	H9	110.526	C3	C2	H6	117.130
Cl4	C1	H5	112.515	H7	C3	H8	108.491
H7	C3	H9	108.491	H8	C3	H9	107.234

All results from a given calculation for C₃H₅Cl (1-chloro-1-propene(Z))

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-chloro-1-propene(Z))

using model chemistry: MP4/6-31G*

States and conformations

All results from a given calculation for C₃H₅Cl (1-chloro-1-propene(Z))