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	hartrees
Energy at 0K	-192.530385
Energy at 298.15K	-192.536603
HF Energy	-191.912574
Nuclear repulsion energy	116.027833

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A	3741	3572
2	A	3253	3106
3	A	3182	3038
4	A	3163	3020
5	A	3035	2897
6	A	2993	2858
7	A	1718	1641
8	A	1562	1492
9	A	1503	1435
10	A	1450	1384
11	A	1327	1267
12	A	1291	1233
13	A	1259	1202
14	A	1180	1127
15	A	1084	1035
16	A	1016	970
17	A	991	946
18	A	934	891
19	A	921	879
20	A	646	617
21	A	451	431
22	A	331	316
23	A	272	259
24	A	112	107

Atom	x (Å)	y (Å)	z (Å)
C1	0.586	0.464	0.277
C2	-0.663	-0.366	0.249
C3	-1.845	0.074	-0.211
O4	1.633	-0.312	-0.322
H5	0.421	1.410	-0.267
H6	0.842	0.719	1.322
H7	-0.563	-1.376	0.652
H8	-2.737	-0.549	-0.189
H9	-1.959	1.076	-0.628
H10	2.463	0.181	-0.203

	C1	C2	C3	O4	H5	H6	H7	H8	H9	H10
C1		1.5002	2.5100	1.4339	1.1041	1.1054	2.2019	3.5053	2.7700	1.9580
C2	1.5002		1.3424	2.3664	2.1442	2.1430	1.0920	2.1275	2.1277	3.2059
C3	2.5100	1.3424		3.5009	2.6310	3.1597	2.1191	1.0886	1.0905	4.3094
O4	1.4339	2.3664	3.5009		2.1069	2.0948	2.6273	4.3783	3.8631	0.9729
H5	1.1041	2.1442	2.6310	2.1069		1.7835	3.0949	3.7173	2.4307	2.3847
H6	1.1054	2.1430	3.1597	2.0948	1.7835		2.6100	4.0863	3.4317	2.2898
H7	2.2019	1.0920	2.1191	2.6273	3.0949	2.6100		2.4729	3.0979	3.5093
H8	3.5053	2.1275	1.0886	4.3783	3.7173	4.0863	2.4729		1.8538	5.2512
H9	2.7700	2.1277	1.0905	3.8631	2.4307	3.4317	3.0979	1.8538		4.5321
H10	1.9580	3.2059	4.3094	0.9729	2.3847	2.2898	3.5093	5.2512	4.5321

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C3	123.916	C1	C2	H7	115.396
C1	O4	H10	107.333	C2	C1	O4	107.496
C2	C1	H5	109.904	C2	C1	H6	109.734
C2	C3	H8	121.777	C2	C3	H9	121.642
C3	C2	H7	120.680	O4	C1	H5	111.565
O4	C1	H6	110.502	H5	C1	H6	107.642
H8	C3	H9	116.581

All results from a given calculation for C₃H₆O (2-Propen-1-ol)

using model chemistry: MP4/6-31G*

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 C3H6O (2-Propen-1-ol)

using model chemistry: MP4/6-31G*

States and conformations

All results from a given calculation for C₃H₆O (2-Propen-1-ol)