C6H5NO2-1

Experimental GED+MW(+ IR + Raman) r_e structure <bib id="KhaikinJSC2015" />:

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14 Nitrobenzene C2v GED+MW dynamic model C 0.168230304939 0.000531685344 -0.000000000000 C -0.487869279051 -1.221475817043 -0.000000000000 C -1.877784855209 -1.206156184165 -0.000000000000 C -2.571514522714 0.001812419907 0.000000000000 C -1.874351645837 1.207802852333 0.000000000000 C -0.484398116501 1.219168866892 -0.000000000000 N 1.650230081140 -0.000282771787 0.000000000000 O 2.213695783050 1.080673935381 -0.000000000000 O 2.212507328297 -1.081858149340 0.000000000000 H 0.085537536419 -2.133141119647 -0.000000000000 H -2.419427878060 -2.139357039178 -0.000000000000 H -3.650514359773 0.002405401853 -0.000000000000 H -2.413338026937 2.142540612878 0.000000000000 H 0.089973841168 2.130226414056 0.000000000000

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