%chk=000134009.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134009

0 1
 O   -1.410000       2.358700     -0.2416000    
 O    1.408100      -2.361600      0.2499000    
 N    2.766200      5.6800000E-02  0.5029000    
 N   -2.762800     -5.9599999E-02 -0.4947000    
 C    3.687400      0.7059000     -0.4389000    
 C    3.688100     -0.7713000     -0.2852000    
 C   -3.675900     -0.7038000      0.4393000    
 C   -3.693100      0.7875000      0.2370000    
 C    1.371300      2.9500000E-02  0.2516000    
 C   -1.373300     -3.2600001E-02 -0.2436000    
 C   0.6578000       1.221700      0.1276000    
 C  -0.6599000      -1.224800     -0.1194000    
 C  -0.7145000       1.190600     -0.1200000    
 C   0.7124000      -1.193700      0.1282000    
 C    1.356300       2.538900      0.2579000    
 C   -1.358200      -2.542000     -0.2510000    
 H    4.457700       1.279100      5.3900000E-02
 H    3.252000       1.112200      -1.339900    
 H    3.278000      -1.343400      -1.104600    
 H    4.460300      -1.229200      0.3143000    
 H   -3.252900      -1.072500       1.362200    
 H   -4.434700      -1.298300     -4.6100002E-02
 H   -4.465200       1.212800     -0.3857000    
 H   -3.312900       1.383200       1.053700    
 H    1.765700       2.853500     -0.7067000    
 H   0.6741000       3.324000      0.6025000    
 H    2.155100       2.510900       1.006200    
 H   -1.780100      -2.850500      0.7103000    
 H   -2.147700      -2.515800      -1.009100    
 H  -0.6738000      -3.330700     -0.5828000    
 H   -2.152400       2.212600     -0.8515000    
 H    2.169300      -2.208400      0.8343000    


%chk=000134009-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134009

0 1
O -1.354331 2.396832 -0.530023
O 1.354124 -2.394393 0.524017
N 2.805111 -0.069171 0.552095
N -2.805611 0.071468 -0.557588
C 3.829428 0.725609 -0.205148
C 3.717137 -0.762345 -0.462896
C -3.830007 -0.723002 0.200035
C -3.717730 0.764923 0.457318
C 1.397781 0.040609 0.237405
C -1.398242 -0.038182 -0.242953
C 0.712455 1.267320 0.019997
C -0.712889 -1.264928 -0.025572
C -0.673023 1.188684 -0.248611
C 0.672572 -1.186272 0.243009
C 1.367115 2.635393 0.109426
C -1.367508 -2.633011 -0.115130
H 4.654064 1.115608 0.399906
H 3.478409 1.393489 -0.999086
H 3.267180 -1.079653 -1.411085
H 4.459025 -1.445782 -0.036998
H -3.479000 -1.390555 0.994248
H -4.654725 -1.113201 -0.404775
H -4.459739 1.448115 0.031230
H -3.267864 1.082445 1.405475
H 1.715956 3.000655 -0.876178
H 0.632631 3.372938 0.471367
H 2.226145 2.627106 0.799842
H -1.716951 -2.998063 0.870344
H -2.226133 -2.624829 -0.806047
H -0.632829 -3.370637 -0.476486
H -2.226843 2.165956 -0.943066
H 2.226690 -2.163428 0.936928


