%chk=000163539.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163539

0 1
 O   -3.545600      0.4667000      -1.543500    
 O   -4.307700      -1.025900       1.659800    
 O  -0.6694000       3.315900      0.1094000    
 O   -2.692900       2.459000      1.6400000E-02
 N   -1.450500       2.344900      4.5100000E-02
 C   -1.761000     -6.4000003E-02 -9.3400002E-02
 C   -3.252700      0.1578000     -0.1803000    
 C   -1.226700      -1.354000     -0.1692000    
 C   -4.084000      -1.065700      0.2512000    
 C  -0.8905000       1.026500      8.9999998E-04
 C    1.071200     -0.4447000     -4.5000002E-02
 C   0.5035000      0.8521000      3.0200001E-02
 C   0.1657000      -1.531700     -0.1485000    
 C    2.504700     -0.5862000     -1.5000000E-02
 C   -2.116600      -2.513700     -0.2731000    
 C   -3.432400      -2.381600     -5.9900001E-02
 C    3.313500      0.5757000      8.8100001E-02
 C    1.332600       1.972300      0.1302000    
 C    2.716500       1.836500      0.1590000    
 C    3.184400      -1.828600     -8.2400002E-02
 C    4.714800      0.4724000      0.1193000    
 C    4.578700      -1.917500     -5.0000001E-02
 C    5.344200     -0.7664000      5.0799999E-02
 H   -3.672400      0.8907000      0.5061000    
 H   -5.063200      -1.041900     -0.2428000    
 H   0.5435000      -2.550200     -0.2108000    
 H   -1.687000      -3.487000     -0.4838000    
 H   -4.066000      -3.263200     -9.8700002E-02
 H    1.150900       3.024500      0.2338000    
 H    3.331900       2.731300      0.2448000    
 H    2.637900      -2.764800     -0.1622000    
 H   -3.186300     -0.2418000      -2.104700    
 H    5.333800       1.364500      0.1982000    
 H   -4.895400     -0.2736000       1.844700    
 H    5.060900      -2.889300     -0.1040000    
 H    6.427700     -0.8302000      7.6300003E-02


%chk=000163539-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000163539

0 1
O -3.604600 0.252192 -1.752433
O -4.185150 -1.048766 1.745568
O -1.073867 3.339181 -0.710172
O -2.417108 2.645516 0.993127
N -1.505690 2.434293 0.100422
C -1.797232 -0.019126 -0.111245
C -3.303178 0.105565 -0.304422
C -1.220538 -1.331649 -0.205367
C -4.096234 -1.095867 0.268968
C -0.921909 1.068255 0.010836
C 1.067449 -0.387540 -0.061064
C 0.510672 0.942280 0.044623
C 0.175174 -1.488605 -0.189208
C 2.522074 -0.568633 -0.020318
C -2.106818 -2.504755 -0.287213
C -3.449665 -2.421707 -0.066336
C 3.367010 0.587499 0.144111
C 1.396285 2.071668 0.211324
C 2.765368 1.893037 0.264842
C 3.151016 -1.846863 -0.135079
C 4.786904 0.432981 0.189183
C 4.545591 -1.978663 -0.089929
C 5.374304 -0.831500 0.074160
H -3.691088 1.036293 0.133799
H -5.109779 -1.036732 -0.181694
H 0.573327 -2.505532 -0.257709
H -1.637506 -3.476750 -0.483097
H -4.080393 -3.316086 -0.061218
H 0.980374 3.078505 0.283189
H 3.423805 2.759676 0.394326
H 2.547298 -2.750044 -0.263695
H -3.251323 -0.544312 -2.230108
H 5.410935 1.325370 0.314891
H -4.693962 -0.237058 2.006927
H 5.001411 -2.970360 -0.181925
H 6.463144 -0.942962 0.108935


