%chk=000129637.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129637

0 1
 O    2.848100       1.623100      0.5429000    
 O    7.674400      0.3350000      0.5201000    
 O    6.653400      -1.488900     -0.3655000    
 N    1.653200     -0.1729000     -0.3429000    
 C   -1.925400      0.7151000     -0.2064000    
 C  -0.8824000     -0.3420000     -0.1751000    
 C   -4.109300     -0.4840000      5.0700001E-02
 C   -5.587700     -0.3773000      0.3325000    
 C   -1.270800       1.896900     -0.3150000    
 C   0.4075000      0.3570000     -0.2678000    
 C   -3.349200      0.6215000      2.3600001E-02
 C   -1.108400      -1.674900     -0.1056000    
 C   0.1593000       1.669400     -0.3559000    
 C   -3.653400      -1.831600     -0.2061000    
 C   -2.408800      -2.320500     -0.2622000    
 C   -5.810300      0.1763000       1.732600    
 C   -6.268300      0.4887000     -0.7190000    
 C   -1.773400       3.300100     -0.3657000    
 C  -1.0800000E-02  -2.698700      8.7399997E-02
 C    2.805000      0.4885000      7.1199998E-02
 C    4.065100     -0.3341000     -0.1251000    
 C    5.309100      0.4191000      0.3383000    
 C    6.583200     -0.3656000      0.1129000    
 H   -6.068000      -1.363800      0.2985000    
 H   -3.836300       1.570700      0.2322000    
 H   0.8626000       2.475800     -0.4934000    
 H   -4.442600      -2.560300     -0.3924000    
 H   -2.350200      -3.385700     -0.4939000    
 H   -5.473800       1.213400       1.838400    
 H   -5.291500     -0.4271000       2.486300    
 H   -6.878000      0.1599000       1.980300    
 H   -6.071100      0.1145000      -1.730100    
 H   -5.952700       1.536700     -0.6771000    
 H   -7.354500      0.4764000     -0.5726000    
 H   -1.487300       3.840900      0.5424000    
 H   -2.859900       3.361200     -0.4655000    
 H   -1.346800       3.827000      -1.226400    
 H    1.742800      -1.154100     -0.5799000    
 H   0.4494000      -2.959000     -0.8713000    
 H  -0.3899000      -3.625000      0.5369000    
 H   0.7532000      -2.347800      0.7877000    
 H    4.149200     -0.5893000      -1.188200    
 H    3.960200      -1.271900      0.4335000    
 H    5.396800       1.364900     -0.2089000    
 H    5.232300      0.6413000       1.408900    
 H    8.504700     -0.1684000      0.3803000    


%chk=000129637-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129637

0 1
O 3.010664 1.786557 -0.227577
O 7.754021 0.071012 0.608516
O 6.825307 -1.063066 -1.190110
N 1.702474 -0.168373 -0.123590
C -1.925046 0.719913 0.018211
C -0.844108 -0.349558 0.003310
C -4.148536 -0.558842 0.183578
C -5.670655 -0.345161 0.252043
C -1.275060 1.999471 -0.060411
C 0.392817 0.374976 -0.083534
C -3.316763 0.593383 0.094163
C -1.071730 -1.754125 0.063194
C 0.115178 1.782803 -0.120069
C -3.662113 -1.882464 0.208319
C -2.339654 -2.391745 0.155219
C -6.089934 0.472432 1.503447
C -6.221210 0.308791 -1.044322
C -1.948902 3.350026 -0.074498
C 0.112191 -2.725034 0.029780
C 2.908924 0.520783 -0.204640
C 4.140463 -0.393839 -0.306904
C 5.378568 0.286636 0.301202
C 6.671993 -0.320415 -0.193738
H -6.139638 -1.345573 0.340954
H -3.850137 1.555364 0.085117
H 0.889680 2.545775 -0.182423
H -4.437039 -2.661172 0.280051
H -2.290853 -3.488530 0.192408
H -5.677502 1.498335 1.471370
H -5.731618 -0.006725 2.432225
H -7.191238 0.557466 1.558508
H -5.962909 -0.291574 -1.935097
H -5.806530 1.323912 -1.189613
H -7.322260 0.401136 -0.994538
H -2.543570 3.528931 0.842503
H -2.634234 3.465303 -0.936725
H -1.197333 4.154445 -0.141489
H 1.780426 -1.183790 -0.103876
H 0.693093 -2.631768 -0.908784
H -0.236471 -3.768763 0.079483
H 0.789153 -2.577545 0.894283
H 4.342348 -0.597803 -1.377121
H 3.957213 -1.375838 0.169960
H 5.358726 1.358866 0.018434
H 5.367317 0.268332 1.404890
H 8.593185 -0.312445 0.233490


