%chk=000018357.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018357

0 1
 O   0.2768000      -2.747800     -1.2000001E-03
 N   -4.505000     -0.1367000      1.7000000E-03
 C  -0.3907000      0.6872000     -6.0000003E-04
 C    1.056100      0.6634000     -3.9999999E-04
 C  -0.8735000     -0.6330000     -1.9999999E-04
 C    1.495200     -0.6719000     -9.9999997E-05
 C   0.2963000      -1.536700       0.000000    
 C   -1.285900       1.742200     -1.0000000E-03
 C   -2.217100     -0.9485000      3.0000001E-04
 C    1.985400       1.688400       0.000000    
 C    2.827800      -1.031300      6.0000003E-04
 C   -3.115400      0.1185000      1.9999999E-04
 C   -2.655500       1.449500     -6.0000003E-04
 C    3.344700       1.351000      6.0000003E-04
 C    3.760700      5.5999998E-03  7.9999998E-04
 H  -0.9498000       2.773800     -1.4000000E-03
 H   -2.554600      -1.978900      1.0000000E-03
 H    1.683600       2.730400       0.000000    
 H    3.143200      -2.067700      8.9999998E-04
 H   -3.367400       2.272300     -3.9999999E-04
 H    4.092600       2.139900      8.9999998E-04
 H    4.822800     -0.2250000      1.3000000E-03
 H   -5.160600      0.6333000      1.9999999E-04
 H   -4.843900      -1.089600      7.9999998E-04


%chk=000018357-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000018357

0 1
O 0.270138 -2.837584 0.000542
N -4.557408 -0.144631 0.000508
C -0.399872 0.710091 -0.000298
C 1.084104 0.680698 -0.000203
C -0.880098 -0.633726 -0.000037
C 1.511696 -0.684444 0.000117
C 0.299822 -1.575200 -0.000393
C -1.329300 1.765722 -0.000383
C -2.241472 -0.945764 0.000227
C 2.042621 1.710894 -0.000129
C 2.869904 -1.034999 0.000594
C -3.190422 0.126199 0.000159
C -2.713505 1.472890 -0.000167
C 3.419803 1.359616 0.000285
C 3.835322 0.005498 0.000645
H -1.001644 2.811445 -0.000524
H -2.567721 -1.992658 0.000395
H 1.745356 2.765427 -0.000308
H 3.166566 -2.089400 0.000773
H -3.440502 2.294456 -0.000183
H 4.176209 2.153084 0.000379
H 4.903679 -0.235223 0.000950
H -5.239847 0.607765 0.000093
H -4.897632 -1.101757 0.000358


