%chk=000226496.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226496

0 1
 N    6.013500      1.6000001E-02  9.1899998E-02
 N   -5.922100      2.4000001E-03 -0.1565000    
 N  -0.3727000     -0.5137000     -0.6907000    
 C    4.603500      4.9500000E-02  0.1087000    
 C    6.714000      -1.171700     -0.3550000    
 C    6.780300       1.163500      0.5344000    
 C   -6.746800      -1.162900      9.3400002E-02
 C   -6.553400       1.301100     -0.2803000    
 C   -4.524000     -0.1277000     -0.2910000    
 C    3.935500      0.8231000       1.058000    
 C    3.877200     -0.6900000     -0.8246000    
 C   -3.817800      0.7500000      -1.113500    
 C   -3.847600      -1.134000      0.3985000    
 C    6.363700      -2.350000      0.5334000    
 C    6.465800       2.367500     -0.3325000    
 C    1.814700      0.1178000      0.1401000    
 C   -7.475000      -1.013500       1.415300    
 C   -6.027700       2.241400      0.7871000    
 C    2.541200      0.8572000       1.073600    
 C    2.482900     -0.6558000     -0.8089000    
 C   -1.765600     -0.3842000     -0.5565000    
 C   -2.435400      0.6215000      -1.246600    
 C   -2.465000      -1.262500      0.2654000    
 C   0.3609000      0.1548000      0.1564000    
 H    7.799600      -1.023800     -0.3060000    
 H    6.502500      -1.394800      -1.406400    
 H    7.856100      0.9650000      0.4560000    
 H    6.605800       1.383300       1.593300    
 H   -7.491900      -1.241700     -0.7088000    
 H   -6.202000      -2.112100      6.5600000E-02
 H   -6.402000       1.725800      -1.279100    
 H   -7.641900       1.223100     -0.1773000    
 H    4.460400       1.398400       1.814000    
 H    4.356800      -1.289500      -1.591800    
 H   -4.305200       1.534700      -1.683300    
 H   -4.353800      -1.814500       1.076800    
 H    6.558300      -2.121000       1.586900    
 H    5.317400      -2.655400      0.4448000    
 H    6.976400      -3.215800      0.2611000    
 H    6.623000       2.141600      -1.393000    
 H    5.438500       2.723100     -0.2149000    
 H    7.126900       3.199400     -6.6900000E-02
 H   -8.051900      -1.920000       1.627000    
 H   -8.178000     -0.1756000       1.419400    
 H   -6.769000     -0.8650000       2.239400    
 H   -6.580600       3.186200      0.7535000    
 H   -4.969100       2.484300      0.6605000    
 H   -6.155800       1.816200       1.788400    
 H    2.034300       1.461500       1.821600    
 H    1.942900      -1.238300      -1.550500    
 H   -1.893100       1.306300      -1.893200    
 H   -1.944400      -2.044500      0.8118000    
 H  -0.1139000      0.7852000      0.9320000    


%chk=000226496-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226496

0 1
N 6.074741 -0.021789 0.051361
N -6.179943 -0.304617 -0.003108
N -0.475281 -0.112734 -0.371116
C 4.681630 -0.004517 0.193571
C 6.718793 -0.168353 -1.269191
C 6.973895 0.106475 1.214670
C -6.872645 -0.613195 1.262593
C -7.001939 0.048270 -1.176936
C -4.776349 -0.232720 -0.059775
C 4.060378 0.248476 1.460715
C 3.812401 -0.241863 -0.926751
C -4.090672 0.126701 -1.266007
C -3.960961 -0.556208 1.073985
C 6.914579 -1.640738 -1.703865
C 7.285077 1.572923 1.599279
C 1.804749 0.030499 0.477539
C -6.961535 0.570838 2.258289
C -7.192062 1.569821 -1.401991
C 2.662184 0.258769 1.589378
C 2.420085 -0.219705 -0.783490
C -1.880575 -0.157976 -0.198421
C -2.688789 0.140846 -1.329508
C -2.558478 -0.520192 1.003558
C 0.350855 0.055081 0.640753
H 7.703418 0.334720 -1.222446
H 6.132079 0.379371 -2.029490
H 7.918071 -0.416530 0.970591
H 6.540410 -0.431818 2.077952
H -7.894684 -0.951046 1.009241
H -6.377265 -1.474664 1.752074
H -6.559883 -0.409655 -2.083096
H -7.992982 -0.424882 -1.045885
H 4.669830 0.452246 2.345775
H 4.232300 -0.460378 -1.912997
H -4.651998 0.388876 -2.166992
H -4.423343 -0.858851 2.018262
H 7.548855 -2.183119 -0.979221
H 5.946411 -2.166980 -1.765167
H 7.403616 -1.692281 -2.694660
H 7.768804 2.103440 0.759055
H 6.361588 2.120050 1.856486
H 7.967570 1.611414 2.468942
H -7.453687 0.249556 3.195685
H -7.545671 1.404596 1.830491
H -5.957453 0.954315 2.509244
H -7.776128 1.752136 -2.323818
H -6.218772 2.080435 -1.503295
H -7.731708 2.031373 -0.556179
H 2.219803 0.458513 2.574533
H 1.766420 -0.403817 -1.642701
H -2.179893 0.402202 -2.263470
H -1.982004 -0.810161 1.890527
H -0.007442 0.248744 1.676028


