%chk=000131494.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131494

3 1
 N  -0.6607000      -1.898000      1.3400000E-02
 N   -4.534200       1.241100      2.6000000E-03
 N    4.892000      0.9076000     -1.9400001E-02
 C   -2.065400      -1.678400      0.5931000    
 C   0.2511000     -0.7973000      0.4078000    
 C   -2.674900     -0.3886000      5.4000001E-02
 C    1.636400      -1.070400     -0.1590000    
 C   -4.076400     -5.5199999E-02  0.5542000    
 C    2.603300      6.3699998E-02  0.1831000    
 C  -0.1402000      -3.248700      0.5255000    
 C  -0.7847000      -1.984100      -1.514600    
 C    3.979100     -0.1921000     -0.4142000    
 C   -4.565600       1.202900      -1.532600    
 C   -5.948200       1.578500      0.4981000    
 C   -3.596700       2.380300      0.4299000    
 C    6.286600      0.7057000     -0.6293000    
 C    4.354100       2.263100     -0.4997000    
 C    5.044700      0.9698000       1.507100    
 H   -1.966100      -1.644100       1.684400    
 H   -2.682500      -2.543400      0.3224000    
 H  -0.1060000      0.1494000     -5.2000000E-03
 H   0.2695000     -0.7315000       1.501900    
 H   -2.017600      0.4330000      0.3316000    
 H   -2.702600     -0.4497000      -1.034200    
 H    1.620200      -1.168800      -1.248900    
 H    2.067300      -1.988400      0.2525000    
 H   -4.090800      1.3600000E-02   1.648700    
 H   -4.789800     -0.8307000      0.2501000    
 H    2.163000      0.9874000     -0.2051000    
 H    2.633000      0.1388000       1.273800    
 H   8.2599998E-02  -3.150700       1.591900    
 H  -0.9264000      -3.995200      0.3726000    
 H   0.7427000      -3.553400     -4.1400000E-02
 H  -0.8478000     -0.9768000      -1.935800    
 H   9.1399997E-02  -2.498700      -1.920200    
 H   -1.674600      -2.572200      -1.760500    
 H    3.934700     -0.2268000      -1.509400    
 H    4.402400      -1.136800     -5.2700002E-02
 H   -3.547000       1.211100      -1.927800    
 H   -5.110400      0.3074000      -1.844900    
 H   -5.084600       2.100800      -1.883300    
 H   -6.253100       2.538300      7.0699997E-02
 H   -6.621500      0.7808000      0.1709000    
 H   -5.920000       1.635300       1.590200    
 H   -3.437900       2.311700       1.509900    
 H   -2.654900       2.318100     -0.1202000    
 H   -4.082400       3.329500      0.1815000    
 H    6.931900       1.531900     -0.3171000    
 H    6.680300     -0.2482000     -0.2666000    
 H    6.181700      0.6902000      -1.718100    
 H    5.144800       3.008200     -0.3645000    
 H    4.096500       2.177600      -1.559400    
 H    3.490900       2.558600      0.1015000    
 H    5.870200       1.651200       1.737200    
 H    4.132300       1.363400       1.961000    
 H    5.274300     -3.4800000E-02   1.873500    


%chk=000131494-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131494

3 1
N -0.654934 -1.666102 -0.212709
N -5.100643 1.156046 0.068291
N 5.422938 0.782077 0.126693
C -2.036889 -1.290074 0.406039
C 0.415972 -0.596291 0.164163
C -2.761195 -0.041204 -0.161079
C 1.865837 -0.937098 -0.256179
C -4.147284 0.031225 0.538965
C 2.852386 0.202771 0.154273
C -0.280215 -3.031895 0.390976
C -0.769860 -1.818997 -1.731987
C 4.292886 -0.219070 -0.223957
C -5.461512 1.003667 -1.413451
C -6.394307 1.034516 0.898710
C -4.494896 2.541119 0.311157
C 6.753228 0.154660 -0.327783
C 5.237107 2.112247 -0.608084
C 5.495297 1.033787 1.635495
H -1.858547 -1.181189 1.490947
H -2.667914 -2.183979 0.253989
H 0.088942 0.345512 -0.310305
H 0.350808 -0.480816 1.261266
H -2.182074 0.877182 0.039698
H -2.894924 -0.141426 -1.252171
H 1.929564 -1.086706 -1.350259
H 2.195318 -1.873024 0.230592
H -4.024019 0.179044 1.626773
H -4.703507 -0.910844 0.383814
H 2.570338 1.138383 -0.363019
H 2.772881 0.379207 1.243155
H -0.166016 -2.930610 1.481340
H -1.080298 -3.753009 0.164202
H 0.655921 -3.391698 -0.056590
H -0.898000 -0.832578 -2.200815
H 0.142928 -2.293083 -2.119552
H -1.629856 -2.466946 -1.962363
H 4.371283 -0.387338 -1.313118
H 4.562153 -1.160408 0.287884
H -4.572043 1.174525 -2.037429
H -5.869444 -0.003996 -1.587473
H -6.225342 1.754105 -1.667777
H -7.091471 1.825958 0.585365
H -6.850830 0.048926 0.719871
H -6.154510 1.154487 1.966365
H -4.225748 2.638909 1.374205
H -3.610706 2.678599 -0.328218
H -5.245375 3.303865 0.053733
H 7.573582 0.848435 -0.090165
H 6.908111 -0.796109 0.204928
H 6.720459 -0.020446 -1.414001
H 6.109159 2.752058 -0.404739
H 5.167237 1.922492 -1.690225
H 4.329235 2.615158 -0.245165
H 6.372648 1.664098 1.845611
H 4.588194 1.556398 1.971631
H 5.601945 0.071480 2.159481


