%chk=000041857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041857

0 1
 O  -3.4800000E-02  0.2887000      -2.391900    
 O  -5.8100000E-02 -0.1291000       2.383400    
 O   -3.385200       2.097200      0.1560000    
 N   -1.711500       1.148000      -1.094900    
 N   -1.724500      0.9415000       1.239100    
 C   1.9700000E-02 -0.2655000     -3.4100000E-02
 C  -0.2565000      -1.756500     -0.1662000    
 C   -1.753200      -2.111200     -0.1253000    
 C    1.507000     -5.0000001E-02 -7.7999998E-03
 C  -0.5539000      0.4141000      -1.280800    
 C  -0.5670000      0.1870000       1.306000    
 C   -2.432800      -1.623200       1.154800    
 C   -2.461300      -1.517400      -1.345400    
 C    2.012200       1.243500      3.3100002E-02
 C    2.359600      -1.146600     -2.5100000E-02
 C   -2.347900       1.433800      0.1030000    
 C    3.392400       1.443600      5.7000000E-02
 C    3.739800     -0.9466000     -1.0000000E-03
 C    4.256200      0.3486000      3.9999999E-02
 H   0.1500000      -2.171800      -1.100000    
 H   0.1775000      -2.320800      0.6724000    
 H   -1.826600      -3.205900     -0.1737000    
 H   -3.109900     -0.7772000       1.067600    
 H   -1.826200      -1.663800       2.060300    
 H   -3.174200      -2.410400       1.378500    
 H   -3.099300     -0.6560000      -1.164200    
 H   -3.207600      -2.269900      -1.646700    
 H   -1.841800      -1.429600      -2.240300    
 H   -2.126800       1.551000      -1.930400    
 H   -2.147600       1.194700       2.127800    
 H    1.353200       2.107300      4.9899999E-02
 H    2.056300      -2.184800     -6.3500002E-02
 H    3.794500       2.452000      8.9599997E-02
 H    4.414000      -1.798100     -1.5799999E-02
 H    5.330800      0.5044000      5.8499999E-02


%chk=000041857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041857

0 1
O -0.344188 0.003744 -2.441405
O -0.313195 -0.349538 2.431217
O -2.550782 3.086348 0.245272
N -1.416635 1.513580 -1.060424
N -1.385717 1.354637 1.298303
C -0.074203 -0.350965 -0.019572
C -0.383263 -1.883285 -0.126535
C -1.860152 -2.387512 -0.169274
C 1.465900 -0.063064 -0.004846
C -0.613382 0.373097 -1.272674
C -0.594452 0.186960 1.332097
C -2.678799 -2.102535 1.114034
C -2.658812 -1.961055 -1.426165
C 1.902567 1.287806 0.026129
C 2.435584 -1.091659 -0.011198
C -1.833676 2.057787 0.166978
C 3.276434 1.603467 0.048117
C 3.813428 -0.775620 0.010683
C 4.240688 0.569787 0.040582
H 0.123358 -2.237094 -1.043909
H 0.105975 -2.357540 0.744603
H -1.741959 -3.491114 -0.230462
H -2.953281 -1.033959 1.197555
H -2.124510 -2.380568 2.027516
H -3.624219 -2.675946 1.091549
H -2.947985 -0.893999 -1.386898
H -3.594989 -2.546054 -1.491345
H -2.082537 -2.119630 -2.354408
H -1.742511 2.009815 -1.896959
H -1.689563 1.731798 2.202471
H 1.173140 2.107631 0.030379
H 2.134683 -2.141765 -0.033967
H 3.592488 2.652150 0.070540
H 4.551814 -1.585044 0.004548
H 5.309249 0.810341 0.057369


