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	hartrees
Energy at 0K	-651.578320
Energy at 298.15K
HF Energy	-650.816513
Nuclear repulsion energy	215.667619

Atom	x (Å)	y (Å)	z (Å)
C1	-0.400	0.679	0.302
Cl2	-1.906	-0.216	-0.045
C3	0.752	0.057	-0.440
C4	1.720	-0.809	0.229
O5	2.040	0.553	-0.073
H6	-0.229	0.656	1.373
H7	-0.542	1.712	-0.002
H8	0.589	-0.072	-1.502
H9	1.582	-1.046	1.278
H10	2.253	-1.564	-0.334

	C1	Cl2	C3	C4	O5	H6	H7	H8	H9	H10
C1		1.7854	1.5049	2.5910	2.4723	1.0848	1.0859	2.1899	2.8029	3.5320
Cl2	1.7854		2.7011	3.6844	4.0202	2.3631	2.3619	2.8925	3.8217	4.3815
C3	1.5049	2.7011		1.4611	1.4278	2.1464	2.1455	1.0824	2.2036	2.2121
C4	2.5910	3.6844	1.4611		1.4306	2.6928	3.3942	2.1958	1.0836	1.0828
O5	2.4723	4.0202	1.4278	1.4306		2.6925	2.8309	2.1302	2.1423	2.1436
H6	1.0848	2.3631	2.1464	2.6928	2.6925		1.7610	3.0763	2.4870	3.7421
H7	1.0859	2.3619	2.1455	3.3942	2.8309	1.7610		2.5902	3.7082	4.3189
H8	2.1899	2.8925	1.0824	2.1958	2.1302	3.0763	2.5902		3.1086	2.5224
H9	2.8029	3.8217	2.2036	1.0836	2.1423	2.4870	3.7082	3.1086		1.8211
H10	3.5320	4.3815	2.2121	1.0828	2.1436	3.7421	4.3189	2.5224	1.8211

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	C4	121.752	C1	C3	O5	114.895
C1	C3	H8	114.664	Cl2	C1	C3	110.065
Cl2	C1	H6	108.355	Cl2	C1	H7	108.212
C3	C1	H6	110.917	C3	C1	H7	110.772
C3	C4	O5	59.163	C3	C4	H9	119.243
C3	C4	H10	120.081	C3	O5	C4	61.482
C4	C3	O5	59.355	C4	C3	H8	118.623
O5	C3	H8	115.442	O5	C4	H9	116.193
O5	C4	H10	116.365	H6	C1	H7	108.435
H9	C4	H10	114.407

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

using model chemistry: MP3/6-31+G**

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: MP3/6-31+G**

States and conformations

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