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	hartrees
Energy at 0K	-194.769377
Energy at 298.15K	-194.777438
HF Energy	-193.959925
Nuclear repulsion energy	161.441589

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3244	3164
2	A'	3241	3161
3	A'	3157	3079
4	A'	3148	3070
5	A'	3140	3062
6	A'	3132	3054
7	A'	1674	1633
8	A'	1493	1456
9	A'	1456	1420
10	A'	1338	1305
11	A'	1296	1264
12	A'	1225	1195
13	A'	1206	1176
14	A'	1028	1002
15	A'	989	965
16	A'	954	930
17	A'	815	795
18	A'	752	733
19	A'	434	423
20	A'	261	254
21	A"	3227	3147
22	A"	3133	3056
23	A"	1450	1414
24	A"	1179	1149
25	A"	1105	1078
26	A"	1042	1017
27	A"	985	961
28	A"	900	878
29	A"	892	870
30	A"	815	795
31	A"	658	642
32	A"	308	300
33	A"	108	105

Atom	x (Å)	y (Å)	z (Å)
C1	-0.402	0.291	0.000
C2	0.259	-1.041	0.000
C3	-0.396	-2.228	0.000
C4	0.259	1.443	0.760
C5	0.259	1.443	-0.760
H6	-1.498	0.274	0.000
H7	1.360	-1.033	0.000
H8	0.148	-3.177	0.000
H9	-1.492	-2.272	0.000
H10	-0.397	2.150	1.277
H11	1.202	1.225	1.271
H12	-0.397	2.150	-1.277
H13	1.202	1.225	-1.271

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.4864	2.5186	1.5301	1.5301	1.0964	2.2036	3.5114	2.7856	2.2552	2.2491	2.2552	2.2491
C2	1.4864		1.3558	2.5976	2.5976	2.1944	1.1007	2.1394	2.1406	3.4985	2.7637	3.4985	2.7637
C3	2.5186	1.3558		3.8055	3.8055	2.7337	2.1235	1.0944	1.0965	4.5599	4.0111	4.5599	4.0111
C4	1.5301	2.5976	3.8055		1.5194	2.2426	2.8149	4.6839	4.1771	1.0937	1.0946	2.2529	2.2498
C5	1.5301	2.5976	3.8055	1.5194		2.2426	2.8149	4.6839	4.1771	2.2529	2.2498	1.0937	1.0946
H6	1.0964	2.1944	2.7337	2.2426	2.2426		3.1425	3.8238	2.5467	2.5220	3.1315	2.5220	3.1315
H7	2.2036	1.1007	2.1235	2.8149	2.8149	3.1425		2.4625	3.1090	3.8534	2.5965	3.8534	2.5965
H8	3.5114	2.1394	1.0944	4.6839	4.6839	3.8238	2.4625		1.8728	5.5050	4.7016	5.5050	4.7016
H9	2.7856	2.1406	1.0965	4.1771	4.1771	2.5467	3.1090	1.8728		4.7314	4.5936	4.7314	4.5936
H10	2.2552	3.4985	4.5599	1.0937	2.2529	2.5220	3.8534	5.5050	4.7314		1.8465	2.5533	3.1468
H11	2.2491	2.7637	4.0111	1.0946	2.2498	3.1315	2.5965	4.7016	4.5936	1.8465		3.1468	2.5428
H12	2.2552	3.4985	4.5599	2.2529	1.0937	2.5220	3.8534	5.5050	4.7314	2.5533	3.1468		1.8465
H13	2.2491	2.7637	4.0111	2.2498	1.0946	3.1315	2.5965	4.7016	4.5936	3.1468	2.5428	1.8465

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	124.722	C1	C2	H7	116.006
C1	C4	C5	60.231	C1	C4	H10	117.559
C1	C4	H11	116.969	C1	C5	C4	60.231
C1	C5	H12	117.559	C1	C5	H13	116.969
C2	C1	C4	118.879	C2	C1	C5	118.879
C2	C1	H6	115.510	C2	C3	H8	121.288
C2	C3	H9	121.237	C3	C2	H7	119.271
C4	C1	H6	116.293	C4	C5	H12	118.207
C4	C5	H13	117.871	C5	C1	H6	116.293
C5	C4	H10	118.207	C5	C4	H11	117.871
H8	C3	H9	117.475	H10	C4	H11	115.090
H12	C5	H13	115.090

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)

using model chemistry: MP4=FULL/aug-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 C5H8 (Ethenylcyclopropane)

using model chemistry: MP4=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for C₅H₈ (Ethenylcyclopropane)