%chk=000048837.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048837

0 1
 O   0.2899000     -0.7164000     -0.4385000    
 O    1.338800       1.922100      5.3900000E-02
 N   -2.334100     -0.1544000      0.4578000    
 C   -1.874200      0.1866000     -0.8889000    
 C  -0.3812000      0.4793000     -0.8591000    
 C  -5.8200002E-02   1.615200      0.1026000    
 C   -3.762100     -0.4293000      0.4590000    
 C   -2.194600     -0.9500000      -1.857600    
 C    1.602500     -0.4865000     -0.1206000    
 C    2.113200      0.7932000      0.1072000    
 C   -4.536900      0.7950000     -2.0500001E-02
 C   -4.199100     -0.8395000       1.861700    
 C    2.436300      -1.600300     -1.7999999E-02
 C    3.467700      0.9640000      0.3947000    
 C    3.787800      -1.429800      0.2829000    
 C    4.303900     -0.1492000      0.4835000    
 H   -2.348000       1.105800      -1.250900    
 H  -2.7000001E-02  0.7267000      -1.869900    
 H   -1.824800     -0.9692000      0.8000000    
 H  -0.6008000       2.525200     -0.1747000    
 H  -0.3067000       1.376900       1.144300    
 H   -4.015300      -1.285500     -0.1754000    
 H   -1.649600     -0.8113000      -2.799100    
 H   -1.904900      -1.929800      -1.460700    
 H   -3.254500     -0.9852000      -2.128400    
 H   -5.606800      0.6701000      0.1843000    
 H   -4.215800       1.707000      0.4962000    
 H   -4.452700      0.9560000      -1.099400    
 H   -3.660600      -1.732700       2.198000    
 H   -5.269400      -1.071900       1.883600    
 H   -4.015400     -4.0100001E-02   2.588600    
 H    2.044300      -2.600400     -0.1814000    
 H    3.876000       1.957000      0.5612000    
 H    4.440300      -2.295000      0.3568000    
 H    5.357400     -1.9099999E-02  0.7136000    


%chk=000048837-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048837

0 1
O 0.282780 -0.739206 -0.478217
O 1.342134 1.947848 -0.049833
N -2.397075 -0.202036 0.282407
C -1.911037 0.118387 -1.081108
C -0.413919 0.477179 -0.989860
C -0.111203 1.653518 -0.052741
C -3.855349 -0.403274 0.485980
C -2.142502 -0.993448 -2.142130
C 1.622940 -0.514948 -0.084924
C 2.141951 0.795534 0.108630
C -4.632243 0.906977 0.230234
C -4.071146 -0.893442 1.932904
C 2.451716 -1.638280 0.111003
C 3.495045 0.969781 0.465011
C 3.802338 -1.461207 0.482502
C 4.326708 -0.155904 0.648741
H -2.430748 1.037594 -1.418729
H -0.013325 0.696046 -2.001096
H -1.847514 -0.981346 0.673046
H -0.592117 2.579568 -0.406312
H -0.455151 1.419054 0.970020
H -4.267605 -1.183802 -0.201621
H -1.831145 -0.654531 -3.148467
H -1.558703 -1.894894 -1.886311
H -3.211183 -1.267925 -2.195799
H -5.706099 0.763777 0.448934
H -4.240529 1.709126 0.881960
H -4.551220 1.242141 -0.820239
H -3.527976 -1.839575 2.121430
H -5.143096 -1.074274 2.128505
H -3.702758 -0.136681 2.649122
H 2.025787 -2.635350 -0.040907
H 3.869762 1.988958 0.602914
H 4.441978 -2.336876 0.633789
H 5.375902 -0.013987 0.927963


