(2), (H2O) (C2H5OH).
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1. .
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). , , , (.1.4).
.1.4
, . , 1.22 Å, . .
2. .
, . (.1.5). O2 .
.1.5 2
: , GaussView. . , RO=O=1.1616 Å, RO-O=1.3200 Å, RO-H=0.9600 Å. , ( Gaussian03 2)
H2O. . GaussView .
2H5OH. . .1.6: (
) . . Hot - . , OH.
. 1.6
1. CO2, NH3, CO, NO2, H2S, HF, N2, H2SO4, HNO3, H2O, H2SO4 (. 3).
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. Ring Fragment 
. C6H6 (. 1.7)
. 1.7
2. : (66), (C6H14), (4), (HCOOH), (108), (C8H8), (48), (l4), (653), (C7H5N3O6), (C19H16), (CH3COOH), (44), (C2H6), (C2H5OH), (24), 65Cl (. 4)
, , 60. .
3. , , 60.
1. Gaussian. .
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3. input -. .
4. GaussView. .
5. Gaussian GaussView.
6. GaussView .
:
, (. ). O2, H2O, C2H5OH, . : 1, 2, 3.
1.
2 Gaussian03
: - , Gaussian03 .
