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	hartrees
Energy at 0K	-192.777388
Energy at 298.15K
HF Energy	-191.987334
Nuclear repulsion energy	124.510155

Atom	x (Å)	y (Å)	z (Å)
C1	-0.235	-0.016	0.484
C2	0.910	-0.741	-0.138
C3	0.881	0.775	-0.136
O4	-1.457	-0.112	-0.196
H5	-0.313	-0.026	1.564
H6	1.612	-1.246	0.508
H7	0.703	-1.230	-1.079
H8	1.562	1.305	0.515
H9	0.664	1.258	-1.079
H10	-1.911	0.729	-0.110

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.4907	1.5018	1.4020	1.0837	2.2192	2.1897	2.2302	2.2072	1.9281
C2	1.4907		1.5170	2.4493	2.2152	1.0801	1.0802	2.2450	2.2227	3.1809
C3	1.5018	1.5170		2.5014	2.2271	2.2445	2.2234	1.0807	1.0807	2.7924
O4	1.4020	2.4493	2.5014		2.1015	3.3469	2.5870	3.4098	2.6747	0.9599
H5	1.0837	2.2152	2.2271	2.1015		2.5126	3.0775	2.5275	3.0966	2.4344
H6	2.2192	1.0801	2.2445	3.3469	2.5126		1.8293	2.5523	3.1124	4.0862
H7	2.1897	1.0802	2.2234	2.5870	3.0775	1.8293		3.1156	2.4882	3.4071
H8	2.2302	2.2450	1.0807	3.4098	2.5275	2.5523	3.1156		1.8295	3.5751
H9	2.2072	2.2227	1.0807	2.6747	3.0966	3.1124	2.4882	1.8295		2.8017
H10	1.9281	3.1809	2.7924	0.9599	2.4344	4.0862	3.4071	3.5751	2.8017

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	59.903	C1	C2	H6	118.496
C1	C2	H7	115.881	C1	C3	C2	59.179
C1	C3	H8	118.536	C1	C3	H9	116.500
C1	O4	H10	107.980	C2	C1	C3	60.918
C2	C1	O4	115.685	C2	C1	H5	117.872
C2	C3	H8	118.631	C2	C3	H9	116.659
C3	C1	O4	118.913	C3	C1	H5	118.040
C3	C2	H6	118.624	C3	C2	H7	116.758
O4	C1	H5	114.839	H6	C2	H7	115.726
H8	C3	H9	115.652

All results from a given calculation for C₃H₅OH (Cyclopropanol)

using model chemistry: QCISD/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: QCISD/aug-cc-pVTZ

States and conformations

All results from a given calculation for C₃H₅OH (Cyclopropanol)