%chk=000095171.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095171

0 1
 O    3.269200       1.459500     -2.2900000E-02
 O   -3.256200      -1.454200      0.1098000    
 N    1.377200      0.1548000      0.3124000    
 N   -1.373900     -0.1537000     -0.2902000    
 C   0.4793000       1.307900      0.4157000    
 C   0.7285000      -1.145200      0.5294000    
 C  -0.7250000       1.146100     -0.5079000    
 C  -0.4759000      -1.306700     -0.3943000    
 C    2.739700      0.3515000      9.4300002E-02
 C   -2.736200     -0.3501000     -7.0500001E-02
 C    3.592800     -0.8878000     -3.4000000E-03
 C   -3.601700      0.8845000     -5.5100001E-02
 C    5.027700     -0.5057000     -0.2747000    
 C   -5.045500      0.4989000      0.1573000    
 H    1.006800       2.237600      0.1813000    
 H   0.1525000       1.365500       1.461000    
 H   0.4066000      -1.165000       1.577600    
 H    1.415300      -1.980400      0.3838000    
 H   -1.411700       1.980900     -0.3589000    
 H  -0.4044000       1.166900      -1.556500    
 H  -0.1489000      -1.363200      -1.439600    
 H   -1.003400      -2.236800     -0.1615000    
 H    3.534600      -1.443300      0.9381000    
 H    3.225600      -1.517200     -0.8206000    
 H   -3.278800       1.542300      0.7584000    
 H   -3.501600       1.410600      -1.009900    
 H    5.649100      -1.404000     -0.3507000    
 H    5.438000      0.1154000      0.5291000    
 H    5.126400      4.8099998E-02  -1.214700    
 H   -5.677200       1.393200      0.1650000    
 H   -5.188400     -1.7300000E-02   1.112900    
 H   -5.408300     -0.1583000     -0.6405000    


%chk=000095171-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095171

0 1
O 3.202450 1.523797 -0.138424
O -3.207187 -1.525674 0.108070
N 1.382757 0.149437 0.301779
N -1.387716 -0.151357 -0.332904
C 0.478153 1.312718 0.403360
C 0.720200 -1.152113 0.523284
C -0.724979 1.149928 -0.555303
C -0.483075 -1.314436 -0.435382
C 2.741224 0.353408 0.045032
C -2.745895 -0.355222 -0.074827
C 3.644932 -0.890607 -0.003330
C -3.649099 0.889072 -0.024078
C 5.122128 -0.517637 -0.224716
C -5.125303 0.516859 0.204993
H 1.065736 2.211594 0.153821
H 0.108223 1.401553 1.445623
H 0.356302 -1.209110 1.570026
H 1.430423 -1.976494 0.362056
H -1.435124 1.974607 -0.395271
H -0.360872 1.205766 -1.602045
H -0.113202 -1.402449 -1.477738
H -1.070364 -2.213641 -0.186377
H 3.535522 -1.462541 0.939750
H 3.300576 -1.562237 -0.815927
H -3.300761 1.562593 0.785153
H -3.544056 1.458748 -0.969110
H 5.745002 -1.429033 -0.275117
H 5.493360 0.121320 0.593959
H 5.246632 0.051742 -1.160616
H -5.747384 1.428584 0.259106
H -5.245165 -0.052850 1.141315
H -5.501239 -0.121526 -0.611961


