%chk=000021570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021570

0 1
 O   0.5999000      0.7593000       1.304600    
 O   -1.670100      0.3471000     -4.0600002E-02
 O  -0.3689000       1.212200      -1.727700    
 N   -5.274500      0.9895000     -0.4665000    
 C   0.6892000     -2.6699999E-02  9.8800004E-02
 C    2.053900      0.1743000     -0.5645000    
 C   0.4546000      -1.502600      0.4282000    
 C  -0.4760000      0.5986000     -0.6725000    
 C    3.179600      0.4288000      0.2190000    
 C  -0.1565000      -2.337700     -0.5071000    
 C    2.171800      0.1035000      -1.952700    
 C   0.8516000      -2.012800       1.664400    
 C   -2.834700      0.8475000     -0.6841000    
 C   -4.050800      0.4784000      0.1502000    
 C   0.7597000       2.134500       1.019000    
 C    4.423100      0.6123000     -0.3857000    
 C  -0.3705000      -3.682900     -0.2064000    
 C    3.415400      0.2869000      -2.557300    
 C   0.6378000      -3.358000       1.964900    
 C    4.540900      0.5413000      -1.773900    
 C   2.6699999E-02  -4.193000       1.029700    
 C    1.146700       2.843500       2.274300    
 C   -5.693400      0.1219000      -1.566700    
 C   -6.339600       1.102800      0.5291000    
 C    2.284100       3.531300       2.423700    
 H    3.122400      0.4653000       1.303100    
 H  -0.4644000      -1.966900      -1.480800    
 H    1.333600     -0.1492000      -2.594000    
 H    1.336900      -1.384700       2.406100    
 H   -2.756100       1.937700     -0.7770000    
 H   -2.891300      0.4081000      -1.685600    
 H   -3.904000      0.9287000       1.141800    
 H   -4.091500     -0.6046000      0.3277000    
 H    1.466000       2.383400      0.2209000    
 H  -0.2083000       2.564100      0.7302000    
 H    5.300800      0.8044000      0.2245000    
 H  -0.8438000      -4.334000     -0.9356000    
 H    3.510200      0.2183000      -3.637000    
 H   0.9489000      -3.755900       2.926400    
 H    5.510000      0.6797000      -2.244400    
 H  -0.1388000      -5.240700       1.263400    
 H   0.4553000       2.792600       3.111500    
 H   -5.886400     -0.9053000      -1.236000    
 H   -6.611800      0.5068000      -2.025000    
 H   -4.948200      9.3400002E-02  -2.367500    
 H   -6.581000      0.1368000      0.9877000    
 H   -7.251400       1.505900      7.4199997E-02
 H   -6.054100       1.801500       1.323400    
 H    3.008300       3.613500       1.620900    
 H    2.507400       4.025300       3.363000    


%chk=000021570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021570

0 1
O 1.089671 1.092047 1.363580
O -1.688475 0.283985 -0.071397
O -0.521241 2.033580 -1.045975
N -5.408101 0.489327 -0.460637
C 0.741872 0.256753 0.168628
C 1.922013 0.198197 -0.818069
C 0.430037 -1.145023 0.724797
C -0.524159 0.945204 -0.415490
C 3.157557 -0.284534 -0.308606
C 0.315852 -2.239048 -0.167940
C 1.843728 0.574937 -2.179838
C 0.231196 -1.356983 2.108731
C -2.971359 0.948736 -0.455506
C -4.073196 -0.074135 -0.154639
C 1.685461 2.431424 1.091848
C 4.289511 -0.386947 -1.140806
C 0.003114 -3.527344 0.314923
C 2.978233 0.460768 -3.018591
C -0.074026 -2.649560 2.592712
C 4.203147 -0.016992 -2.505073
C -0.193794 -3.738502 1.699925
C 1.589103 3.210524 2.376466
C -5.707814 0.529320 -1.907476
C -6.489933 -0.163189 0.305152
C 2.645819 3.795829 2.992380
H 3.217257 -0.579903 0.745118
H 0.480790 -2.086790 -1.240986
H 0.911972 0.974266 -2.589162
H 0.326064 -0.510975 2.793538
H -3.097183 1.863249 0.149094
H -2.915010 1.234220 -1.520556
H -4.030944 -0.319494 0.921472
H -3.862585 -1.019571 -0.713491
H 2.736069 2.314689 0.765594
H 1.112116 2.930098 0.285038
H 5.235101 -0.759511 -0.731136
H -0.081436 -4.365505 -0.386181
H 2.902457 0.754238 -4.071678
H -0.219883 -2.804583 3.668000
H 5.080329 -0.100749 -3.156523
H -0.431640 -4.739708 2.077172
H 0.578219 3.307756 2.796329
H -5.760967 -0.489023 -2.370839
H -6.679043 1.029915 -2.068016
H -4.941225 1.110785 -2.447784
H -6.633225 -1.242514 0.044390
H -7.443968 0.360564 0.114568
H -6.275799 -0.096842 1.386271
H 3.665246 3.702126 2.597700
H 2.521775 4.389089 3.905071


