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	hartrees
Energy at 0K	-194.803399
Energy at 298.15K	-194.811551
HF Energy	-194.001671
Nuclear repulsion energy	162.751684

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3248	3126
2	A'	3246	3124
3	A'	3171	3052
4	A'	3157	3039
5	A'	3153	3035
6	A'	3140	3022
7	A'	1689	1626
8	A'	1529	1472
9	A'	1483	1427
10	A'	1364	1313
11	A'	1319	1270
12	A'	1245	1198
13	A'	1222	1176
14	A'	1100	1059
15	A'	1017	979
16	A'	961	925
17	A'	833	802
18	A'	784	754
19	A'	443	427
20	A'	269	259
21	A"	3233	3112
22	A"	3147	3029
23	A"	1491	1436
24	A"	1220	1175
25	A"	1149	1106
26	A"	1103	1062
27	A"	984	947
28	A"	931	896
29	A"	841	809
30	A"	822	791
31	A"	656	631
32	A"	315	304
33	A"	118	114

Atom	x (Å)	y (Å)	z (Å)
C1	-0.390	0.288	0.000
C2	0.259	-1.042	0.000
C3	-0.405	-2.206	0.000
C4	0.259	1.433	0.753
C5	0.259	1.433	-0.753
H6	-1.476	0.272	0.000
H7	1.349	-1.042	0.000
H8	0.117	-3.155	0.000
H9	-1.491	-2.237	0.000
H10	-0.391	2.133	1.264
H11	1.196	1.225	1.258
H12	-0.391	2.133	-1.264
H13	1.196	1.225	-1.258

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4799	2.4939	1.5170	1.5170	1.0859	2.1902	3.4805	2.7541	2.2364	2.2310	2.2364	2.2310
C2	1.4799		1.3405	2.5871	2.5871	2.1767	1.0901	2.1184	2.1192	3.4783	2.7564	3.4783	2.7564
C3	2.4939	1.3405		3.7753	3.7753	2.6995	2.1054	1.0838	1.0858	4.5190	3.9897	4.5190	3.9897
C4	1.5170	2.5871	3.7753		1.5067	2.2198	2.8080	4.6521	4.1351	1.0834	1.0843	2.2324	2.2285
C5	1.5170	2.5871	3.7753	1.5067		2.2198	2.8080	4.6521	4.1351	2.2324	2.2285	1.0834	1.0843
H6	1.0859	2.1767	2.6995	2.2198	2.2198		3.1165	3.7798	2.5090	2.4973	3.1035	2.4973	3.1035
H7	2.1902	1.0901	2.1054	2.8080	2.8080	3.1165		2.4458	3.0811	3.8354	2.5975	3.8354	2.5975
H8	3.4805	2.1184	1.0838	4.6521	4.6521	3.7798	2.4458		1.8520	5.4607	4.6832	5.4607	4.6832
H9	2.7541	2.1192	1.0858	4.1351	4.1351	2.5090	3.0811	1.8520		4.6796	4.5591	4.6796	4.5591
H10	2.2364	3.4783	4.5190	1.0834	2.2324	2.4973	3.8354	5.4607	4.6796		1.8287	2.5287	3.1154
H11	2.2310	2.7564	3.9897	1.0843	2.2285	3.1035	2.5975	4.6832	4.5591	1.8287		3.1154	2.5158
H12	2.2364	3.4783	4.5190	2.2324	1.0834	2.4973	3.8354	5.4607	4.6796	2.5287	3.1154		1.8287
H13	2.2310	2.7564	3.9897	2.2285	1.0843	3.1035	2.5975	4.6832	4.5591	3.1154	2.5158	1.8287

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.236	C1	C2	H7	116.081
C1	C4	C5	60.225	C1	C4	H10	117.667
C1	C4	H11	117.137	C1	C5	C4	60.225
C1	C5	H12	117.667	C1	C5	H13	117.137
C2	C1	C4	119.359	C2	C1	C5	119.359
C2	C1	H6	115.207	C2	C3	H8	121.441
C2	C3	H9	121.353	C3	C2	H7	119.683
C4	C1	H6	116.056	C4	C5	H12	118.144
C4	C5	H13	117.733	C5	C1	H6	116.056
C5	C4	H10	118.144	C5	C4	H11	117.733
H8	C3	H9	117.206	H10	C4	H11	115.056
H12	C5	H13	115.056

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: CCSD(T)/TZVP

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 C5H8 (Ethenylcyclopropane)

using model chemistry: CCSD(T)/TZVP

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)