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	hartrees
Energy at 0K	-194.656235
Energy at 298.15K	-194.664379
HF Energy	-193.937981
Nuclear repulsion energy	162.285515

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3241	3118
2	A'	3240	3118
3	A'	3160	3040
4	A'	3158	3038
5	A'	3153	3034
6	A'	3131	3012
7	A'	1715	1650
8	A'	1551	1492
9	A'	1497	1440
10	A'	1381	1329
11	A'	1334	1284
12	A'	1258	1211
13	A'	1242	1195
14	A'	1096	1055
15	A'	1026	987
16	A'	983	946
17	A'	840	809
18	A'	785	755
19	A'	445	429
20	A'	271	261
21	A"	3227	3105
22	A"	3148	3029
23	A"	1508	1450
24	A"	1224	1177
25	A"	1153	1110
26	A"	1097	1055
27	A"	1000	962
28	A"	944	908
29	A"	887	853
30	A"	848	816
31	A"	667	642
32	A"	314	302
33	A"	114	110

Atom	x (Å)	y (Å)	z (Å)
C1	-0.388	0.290	0.000
C2	0.259	-1.045	0.000
C3	-0.407	-2.213	0.000
C4	0.259	1.439	0.753
C5	0.259	1.439	-0.753
H6	-1.480	0.272	0.000
H7	1.355	-1.050	0.000
H8	0.114	-3.169	0.000
H9	-1.497	-2.250	0.000
H10	-0.393	2.138	1.273
H11	1.198	1.235	1.266
H12	-0.393	2.138	-1.273
H13	1.198	1.235	-1.266

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4832	2.5031	1.5181	1.5181	1.0919	2.1978	3.4954	2.7714	2.2445	2.2392	2.2445	2.2392
C2	1.4832		1.3448	2.5951	2.5951	2.1811	1.0953	2.1294	2.1299	3.4898	2.7724	3.4898	2.7724
C3	2.5031	1.3448		3.7876	3.7876	2.7068	2.1109	1.0890	1.0908	4.5338	4.0093	4.5338	4.0093
C4	1.5181	2.5951	3.7876		1.5050	2.2250	2.8211	4.6713	4.1541	1.0891	1.0897	2.2403	2.2359
C5	1.5181	2.5951	3.7876	1.5050		2.2250	2.8211	4.6713	4.1541	2.2403	2.2359	1.0891	1.0897
H6	1.0919	2.1811	2.7068	2.2250	2.2250		3.1272	3.7925	2.5220	2.5069	3.1151	2.5069	3.1151
H7	2.1978	1.0953	2.1109	2.8211	2.8211	3.1272		2.4557	3.0938	3.8521	2.6174	3.8521	2.6174
H8	3.4954	2.1294	1.0890	4.6713	4.6713	3.7925	2.4557		1.8552	5.4816	4.7098	5.4816	4.7098
H9	2.7714	2.1299	1.0908	4.1541	4.1541	2.5220	3.0938	1.8552		4.7006	4.5845	4.7006	4.5845
H10	2.2445	3.4898	4.5338	1.0891	2.2403	2.5069	3.8521	5.4816	4.7006		1.8297	2.5469	3.1302
H11	2.2392	2.7724	4.0093	1.0897	2.2359	3.1151	2.6174	4.7098	4.5845	1.8297		3.1302	2.5326
H12	2.2445	3.4898	4.5338	2.2403	1.0891	2.5069	3.8521	5.4816	4.7006	2.5469	3.1302		1.8297
H13	2.2392	2.7724	4.0093	2.2359	1.0897	3.1151	2.6174	4.7098	4.5845	3.1302	2.5326	1.8297

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.452	C1	C2	H7	116.117
C1	C4	C5	60.285	C1	C4	H10	117.896
C1	C4	H11	117.383	C1	C5	C4	60.285
C1	C5	H12	117.896	C1	C5	H13	117.383
C2	C1	C4	119.677	C2	C1	C5	119.677
C2	C1	H6	114.923	C2	C3	H8	121.716
C2	C3	H9	121.618	C3	C2	H7	119.431
C4	C1	H6	116.006	C4	C5	H12	118.577
C4	C5	H13	118.129	C5	C1	H6	116.006
C5	C4	H10	118.577	C5	C4	H11	118.129
H8	C3	H9	116.665	H10	C4	H11	114.235
H12	C5	H13	114.235

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: CCSD(T)/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 C5H8 (Ethenylcyclopropane)

using model chemistry: CCSD(T)/6-31G*

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)