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	hartrees
Energy at 0K	-192.820823
Energy at 298.15K	-192.827806
HF Energy	-191.987577
Nuclear repulsion energy	125.057424

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3846	3659	38.81
2	A	3288	3128	4.70
3	A	3271	3112	1.29
4	A	3203	3048	3.81
5	A	3190	3035	8.41
6	A	3183	3028	17.26
7	A	1524	1450	17.09
8	A	1469	1397	2.49
9	A	1424	1355	11.82
10	A	1300	1237	44.18
11	A	1250	1190	68.06
12	A	1201	1142	9.56
13	A	1198	1140	2.49
14	A	1129	1074	1.44
15	A	1054	1002	1.38
16	A	1033	983	27.02
17	A	1003	954	10.92
18	A	946	900	24.31
19	A	843	802	10.86
20	A	823	783	7.10
21	A	757	720	3.15
22	A	409	389	16.42
23	A	408	388	2.98
24	A	314	299	105.98

Atom	x (Å)	y (Å)	z (Å)
C1	-0.230	-0.014	0.484
C2	0.903	-0.739	-0.140
C3	0.877	0.771	-0.137
O4	-1.450	-0.112	-0.193
H5	-0.301	-0.027	1.561
H6	1.606	-1.242	0.500
H7	0.684	-1.221	-1.076
H8	1.560	1.296	0.509
H9	0.654	1.248	-1.076
H10	-1.897	0.735	-0.117

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.4827	1.4933	1.3984	1.0794	2.2091	2.1744	2.2191	2.1931	1.9234
C2	1.4827		1.5108	2.4354	2.2023	1.0756	1.0758	2.2349	2.2108	3.1638
C3	1.4933	1.5108		2.4900	2.2157	2.2343	2.2116	1.0763	1.0763	2.7741
O4	1.3984	2.4354	2.4900		2.0985	3.3310	2.5621	3.3967	2.6566	0.9609
H5	1.0794	2.2023	2.2157	2.0985		2.4981	3.0584	2.5145	3.0808	2.4376
H6	2.2091	1.0756	2.2343	3.3310	2.4981		1.8261	2.5389	3.0971	4.0691
H7	2.1744	1.0758	2.2116	2.5621	3.0584	1.8261		3.1012	2.4698	3.3775
H8	2.2191	2.2349	1.0763	3.3967	2.5145	2.5389	3.1012		1.8258	3.5575
H9	2.1931	2.2108	1.0763	2.6566	3.0808	3.0971	2.4698	1.8258		2.7726
H10	1.9234	3.1638	2.7741	0.9609	2.4376	4.0691	3.3775	3.5575	2.7726

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	59.840	C1	C2	H6	118.554
C1	C2	H7	115.474	C1	C3	C2	59.145
C1	C3	H8	118.541	C1	C3	H9	116.235
C1	O4	H10	107.778	C2	C1	C3	61.015
C2	C1	O4	115.374	C2	C1	H5	117.672
C2	C3	H8	118.543	C2	C3	H9	116.406
C3	C1	O4	118.841	C3	C1	H5	118.010
C3	C2	H6	118.532	C3	C2	H7	116.516
O4	C1	H5	115.156	H6	C2	H7	116.161
H8	C3	H9	116.025

All results from a given calculation for C₃H₅OH (Cyclopropanol)

using model chemistry: MP2=FULL/aug-cc-pVTZ

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 C3H5OH (Cyclopropanol)

using model chemistry: MP2=FULL/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)