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	hartrees
Energy at 0K	-190.414001
Energy at 298.15K	-190.418754
HF Energy	-189.853023
Nuclear repulsion energy	81.263389

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3854	3662	41.78
2	A	3188	3029	17.27
3	A	3151	2995	44.29
4	A	3065	2913	34.12
5	A	1541	1464	8.60
6	A	1487	1413	5.74
7	A	1482	1408	1.27
8	A	1381	1312	54.15
9	A	1226	1165	6.94
10	A	1200	1140	3.24
11	A	1085	1031	20.77
12	A	880	836	11.68
13	A	457	434	7.24
14	A	271	257	4.69
15	A	172	163	131.13

Atom	x (Å)	y (Å)	z (Å)
C1	1.119	-0.225	0.027
O2	-0.018	0.612	-0.032
O3	-1.151	-0.289	-0.090
H4	1.967	0.464	0.029
H5	1.123	-0.829	0.940
H6	1.172	-0.878	-0.849
H7	-1.621	0.008	0.698

	C1	O2	O3	H4	H5	H6	H7
C1		1.4132	2.2744	1.0921	1.0949	1.0938	2.8304
O2	1.4132		1.4482	1.9915	2.0789	2.0745	1.8613
O3	2.2744	1.4482		3.2098	2.5542	2.5141	0.9636
H4	1.0921	1.9915	3.2098		1.7929	1.7897	3.6777
H5	1.0949	2.0789	2.5542	1.7929		1.7902	2.8783
H6	1.0938	2.0745	2.5141	1.7897	1.7902		3.3129
H7	2.8304	1.8613	0.9636	3.6777	2.8783	3.3129

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	O2	O3	105.278	O2	C1	H4	104.563
O2	C1	H5	111.333	O2	C1	H6	111.038
O2	O3	H7	99.043	H4	C1	H5	110.130
H4	C1	H6	109.919	H5	C1	H6	109.752

All results from a given calculation for CH₃OOH (Methyl peroxide)

using model chemistry: MP2/6-311G**

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 CH3OOH (Methyl peroxide)

using model chemistry: MP2/6-311G**

States and conformations

All results from a given calculation for CH₃OOH (Methyl peroxide)