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	hartrees
Energy at 0K	-192.757788
Energy at 298.15K	-192.764827
HF Energy	-191.984826
Nuclear repulsion energy	124.712927

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3898	3640	33.46
2	A	3278	3060	10.28
3	A	3263	3046	2.10
4	A	3184	2973	5.43
5	A	3174	2964	12.66
6	A	3168	2958	23.41
7	A	1543	1440	16.69
8	A	1479	1381	2.03
9	A	1447	1351	7.00
10	A	1334	1246	85.61
11	A	1264	1180	45.89
12	A	1217	1136	2.62
13	A	1215	1134	2.01
14	A	1155	1078	0.88
15	A	1094	1022	1.01
16	A	1074	1003	19.56
17	A	1014	947	9.57
18	A	961	897	24.64
19	A	853	797	9.62
20	A	836	780	7.34
21	A	770	719	3.56
22	A	416	389	19.76
23	A	411	384	4.77
24	A	321	300	104.79

Atom	x (Å)	y (Å)	z (Å)
C1	-0.236	-0.017	0.482
C2	0.909	-0.740	-0.138
C3	0.879	0.775	-0.135
O4	-1.455	-0.112	-0.196
H5	-0.310	-0.026	1.562
H6	1.612	-1.244	0.507
H7	0.704	-1.229	-1.078
H8	1.559	1.304	0.515
H9	0.664	1.257	-1.077
H10	-1.901	0.730	-0.112

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.4895	1.5004	1.3973	1.0829	2.2184	2.1876	2.2291	2.2057	1.9188
C2	1.4895		1.5150	2.4459	2.2109	1.0790	1.0790	2.2417	2.2201	3.1713
C3	1.5004	1.5150		2.4969	2.2218	2.2416	2.2211	1.0796	1.0796	2.7799
O4	1.3973	2.4459	2.4969		2.0994	3.3431	2.5852	3.4048	2.6724	0.9575
H5	1.0829	2.2109	2.2218	2.0994		2.5085	3.0737	2.5218	3.0923	2.4297
H6	2.2184	1.0790	2.2416	3.3431	2.5085		1.8267	2.5479	3.1082	4.0767
H7	2.1876	1.0790	2.2211	2.5852	3.0737	1.8267		3.1115	2.4859	3.3996
H8	2.2291	2.2417	1.0796	3.4048	2.5218	2.5479	3.1115		1.8269	3.5627
H9	2.2057	2.2201	1.0796	2.6724	3.0923	3.1082	2.4859	1.8269		2.7910
H10	1.9188	3.1713	2.7799	0.9575	2.4297	4.0767	3.3996	3.5627	2.7910

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	59.911	C1	C2	H6	118.594
C1	C2	H7	115.879	C1	C3	C2	59.198
C1	C3	H8	118.633	C1	C3	H9	116.560
C1	O4	H10	107.680	C2	C1	C3	60.891
C2	C1	O4	115.801	C2	C1	H5	117.649
C2	C3	H8	118.573	C2	C3	H9	116.666
C3	C1	O4	118.970	C3	C1	H5	117.740
C3	C2	H6	118.601	C3	C2	H7	116.791
O4	C1	H5	115.067	H6	C2	H7	115.661
H8	C3	H9	115.582

All results from a given calculation for C₃H₅OH (Cyclopropanol)

using model chemistry: CCD/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: CCD/cc-pVTZ

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)