%chk=000134787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134787

0 1
 O   -5.831500      -1.521400      0.5989000    
 O   -6.068500       1.220000      -1.062700    
 O    5.009700      0.2096000      0.2306000    
 O    2.593300       3.412500      0.2718000    
 O    4.599000       2.532100      0.4156000    
 O    3.510400      -3.515500     -0.3149000    
 O    5.244300      -2.209000      1.0200000E-02
 N    3.362600       2.426400      0.2584000    
 N    4.012100      -2.379600     -0.1442000    
 C   -3.471500     -0.8241000      0.3418000    
 C   -2.903300      0.4472000     -0.3235000    
 C   -1.429800      0.6686000      1.8700000E-02
 C  -0.6062000     -0.5431000     -0.5141000    
 C   -4.930800     -0.7186000     -0.1434000    
 C   -2.699700      -2.032200     -0.2036000    
 C   -3.925200       1.528100      3.1500001E-02
 C   -5.272400      0.7776000      2.8700000E-02
 C   -1.180700      -1.886700      9.8999999E-03
 C  -0.8713000       1.955900     -0.5907000    
 C   -3.411800     -0.8318000       1.889800    
 C   0.8886000     -0.3431000     -0.2786000    
 C   0.5524000       2.187900     -9.3300000E-02
 C    1.422700      0.9553000     -0.1253000    
 C    1.780300      -1.430200     -0.2977000    
 C    2.806600       1.126600      5.5799998E-02
 C    3.153800      -1.245100     -0.1256000    
 C    3.666900      3.2600001E-02  5.5900000E-02
 H   -2.961000      0.3253000      -1.418300    
 H   -1.313900      0.7420000       1.107800    
 H  -0.7198000     -0.5658000      -1.609200    
 H   -5.016600      -1.020300      -1.195100    
 H   -2.887600      -2.141100      -1.279900    
 H   -3.050700      -2.959700      0.2646000    
 H   -3.721300       1.932000       1.029600    
 H   -3.902100       2.359600     -0.6805000    
 H   -5.835400      0.9760000      0.9466000    
 H  -0.9390000      -2.004000       1.073100    
 H  -0.7069000      -2.729900     -0.5055000    
 H   -1.486500       2.822600     -0.3235000    
 H  -0.8834000       1.883600      -1.686600    
 H   -2.390500     -0.7645000       2.273500    
 H   -3.974400     -5.5000000E-03   2.335100    
 H   -3.838000      -1.760800       2.286500    
 H   0.4929000       2.581000      0.9290000    
 H   0.8979000       2.939300     -0.8109000    
 H   -6.728300      -1.327700      0.2771000    
 H   -5.557900       1.091700      -1.880400    
 H    1.386700      -2.429000     -0.4608000    
 H    5.398400     -0.5710000      0.6556000    


%chk=000134787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134787

0 1
O -5.818415 -1.678826 0.505707
O -6.385175 1.212761 -0.852695
O 5.076869 0.242731 0.338750
O 3.093144 3.161106 1.258857
O 4.249602 2.876033 -0.689470
O 3.473681 -3.627604 -0.112667
O 5.294431 -2.295584 0.217341
N 3.445279 2.471869 0.226340
N 3.994126 -2.464364 0.026989
C -3.471717 -0.842574 0.302629
C -2.907036 0.458238 -0.359294
C -1.430225 0.697293 -0.002719
C -0.601992 -0.519844 -0.522889
C -4.939880 -0.738012 -0.179640
C -2.677682 -2.049494 -0.246564
C -3.968049 1.547764 -0.041661
C -5.317463 0.757494 0.052999
C -1.151948 -1.884061 -0.009824
C -0.851699 1.988943 -0.613374
C -3.434334 -0.823641 1.853776
C 0.899105 -0.326048 -0.264972
C 0.583813 2.238086 -0.110780
C 1.457302 0.991422 -0.107774
C 1.765747 -1.429958 -0.215907
C 2.851317 1.116489 0.076710
C 3.156861 -1.276588 -0.020246
C 3.747711 0.019277 0.125985
H -2.936675 0.282262 -1.460862
H -1.328672 0.761843 1.101809
H -0.739942 -0.520550 -1.630015
H -4.968167 -0.930086 -1.281119
H -2.869060 -2.142371 -1.336734
H -3.025415 -2.989686 0.220766
H -3.749176 2.057275 0.915008
H -4.025450 2.333604 -0.816702
H -5.781849 0.863525 1.047525
H -0.915989 -1.991634 1.066782
H -0.638578 -2.717120 -0.526090
H -1.477937 2.860065 -0.346473
H -0.864289 1.908738 -1.719668
H -2.409928 -0.944629 2.244032
H -3.840429 0.113691 2.274203
H -4.052074 -1.652914 2.237490
H 0.554336 2.626877 0.926886
H 1.066654 3.037306 -0.705261
H -6.752934 -1.486713 0.238573
H -6.041623 1.206812 -1.783104
H 1.391057 -2.450047 -0.323197
H 5.535370 -0.675355 0.348340


