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	hartrees
Energy at 0K	-651.147009
Energy at 298.15K	-651.152999
HF Energy	-650.704680
Nuclear repulsion energy	206.914323

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3266	3153	20.58
2	A	3209	3098	11.61
3	A	3189	3078	5.29
4	A	3144	3035	18.43
5	A	3116	3008	15.65
6	A	1540	1487	2.19
7	A	1518	1465	7.11
8	A	1444	1394	0.35
9	A	1344	1297	22.46
10	A	1264	1220	0.15
11	A	1241	1198	1.14
12	A	1172	1131	8.83
13	A	1154	1114	1.91
14	A	1076	1039	1.38
15	A	1045	1009	0.52
16	A	944	911	6.01
17	A	918	886	1.92
18	A	776	749	29.14
19	A	706	681	20.46
20	A	678	655	26.39
21	A	405	391	0.10
22	A	345	333	4.94
23	A	200	193	17.85
24	A	91	88	10.63

Atom	x (Å)	y (Å)	z (Å)
C1	-0.362	-0.765	-0.267
Cl2	-1.967	0.221	0.030
C3	0.777	-0.095	0.482
C4	1.659	0.913	-0.197
O5	2.174	-0.537	-0.014
H6	-0.188	-0.763	-1.352
H7	-0.561	-1.780	0.102
H8	0.693	-0.069	1.573
H9	1.457	1.182	-1.237
H10	2.190	1.652	0.407

	C1	Cl2	C3	C4	O5	H6	H7	H8	H9	H10
C1		1.9074	1.5191	2.6277	2.5581	1.0983	1.0977	2.2327	2.8355	3.5792
Cl2	1.9074		2.7990	3.6984	4.2095	2.4580	2.4467	3.0889	3.7747	4.4122
C3	1.5191	2.7990		1.5012	1.5461	2.1772	2.1847	1.0948	2.2468	2.2483
C4	2.6277	3.6984	1.5012		1.5489	2.7487	3.5024	2.2423	1.0938	1.0923
O5	2.5581	4.2095	1.5461	1.5489		2.7238	3.0058	2.2201	2.2286	2.2296
H6	1.0983	2.4580	2.1772	2.7487	2.7238		1.8127	3.1326	2.5501	3.8187
H7	1.0977	2.4467	2.1847	3.5024	3.0058	1.8127		2.5815	3.8258	4.4090
H8	2.2327	3.0889	1.0948	2.2423	2.2201	3.1326	2.5815		3.1694	2.5617
H9	2.8355	3.7747	2.2468	1.0938	2.2286	2.5501	3.8258	3.1694		1.8605
H10	3.5792	4.4122	2.2483	1.0923	2.2296	3.8187	4.4090	2.5617	1.8605

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C4	120.923	C1	C3	O5	113.142
C1	C3	H8	116.394	Cl2	C1	C3	109.023
Cl2	C1	H6	106.601	Cl2	C1	H7	105.843
C3	C1	H6	111.560	C3	C1	H7	112.204
C3	C4	O5	60.890	C3	C4	H9	119.111
C3	C4	H10	119.368	C3	O5	C4	58.030
C4	C3	O5	61.080	C4	C3	H8	118.643
O5	C3	H8	113.311	O5	C4	H9	113.861
O5	C4	H10	114.047	H6	C1	H7	111.265
H9	C4	H10	116.649

All results from a given calculation for C₃H₅ClO (Oxirane, (chloromethyl)-)

using model chemistry: MP2/SDD

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 C3H5ClO (Oxirane, (chloromethyl)-)

using model chemistry: MP2/SDD

States and conformations

All results from a given calculation for C₃H₅ClO (Oxirane, (chloromethyl)-)