%chk=000175302.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175302

0 1
 O   0.2358000      -1.979500     -9.3699999E-02
 N    10.44940       2.036900      0.1766000    
 C   -7.110500     -0.2918000      0.2354000    
 C   -5.748900     -7.3000002E-03 -0.4073000    
 C   -8.234600      0.5890000     -0.3148000    
 C   -4.598500     -0.9123000      4.6000000E-02
 C   -9.580100      0.3602000      0.3822000    
 C   -3.225400     -0.5942000     -0.5530000    
 C   -10.72520       1.275000     -6.3000001E-02
 C   -2.103100      -1.471200     -1.5000000E-03
 C   -12.05510      0.9642000      0.6241000    
 C  -0.7673000      -1.145000     -0.6560000    
 C   -13.15520       1.903400      0.1535000    
 C    1.510600      -1.476900     -5.9200000E-02
 C    1.922800     -0.5792000      -1.037300    
 C    2.378300      -1.871200      0.9527000    
 C    4.097000     -0.4593000      9.3999999E-03
 C    3.220400     -6.8700001E-02  -1.002800    
 C    3.675900      -1.360600      0.9871000    
 C    5.443000      6.9499999E-02  4.4799998E-02
 C    6.084700      0.4236000      -1.142000    
 C    6.099300      0.2253000       1.265700    
 C    7.382600      0.9335000      -1.107800    
 C    7.397200      0.7352000       1.299700    
 C    8.038800       1.089400      0.1131000    
 C    9.368200       1.611900      0.1481000    
 H   -7.370300      -1.345500      7.7100001E-02
 H   -7.028500     -0.1450000       1.319300    
 H   -5.476500       1.035900     -0.2032000    
 H   -5.846800     -9.3199998E-02  -1.496900    
 H   -7.952300       1.643000     -0.2011000    
 H   -8.349700      0.4062000      -1.390100    
 H   -4.855300      -1.952600     -0.1899000    
 H   -4.524900     -0.8532000       1.139400    
 H   -9.879900     -0.6838000      0.2245000    
 H   -9.441700      0.4812000       1.464300    
 H   -2.988100      0.4592000     -0.3587000    
 H   -3.279600     -0.7101000      -1.642500    
 H   -10.84980       1.184000      -1.149200    
 H   -10.44570       2.316900      0.1365000    
 H   -2.020800      -1.341800       1.084800    
 H   -2.337400      -2.531100     -0.1610000    
 H   -12.34860     -7.0699997E-02  0.4140000    
 H   -11.94160       1.055800       1.710300    
 H  -0.8233000      -1.327900      -1.735300    
 H  -0.5582000     -8.2300000E-02 -0.4760000    
 H   -12.90460       2.945100      0.3782000    
 H   -13.31350       1.812700     -0.9259000    
 H   -14.09760       1.664600      0.6563000    
 H    1.279400     -0.2670000      -1.854200    
 H    2.055700      -2.578100       1.711900    
 H    3.495600      0.6489000      -1.770800    
 H    4.332000      -1.717400       1.776300    
 H    5.625800      0.2913000      -2.118000    
 H    5.629000     -7.6000001E-03   2.217000    
 H    7.872500       1.199000      -2.041700    
 H    7.893600      0.8573000       2.259600    


%chk=000175302-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175302

0 1
O 0.214584 -1.034890 0.794056
N 11.194478 0.583262 -0.974791
C -7.293429 -0.146725 0.369672
C -5.915360 0.344721 -0.127883
C -8.479895 0.603215 -0.276481
C -4.730594 -0.417779 0.505948
C -9.858414 0.115049 0.223380
C -3.352583 0.080644 0.014926
C -11.045232 0.858272 -0.430035
C -2.177733 -0.708049 0.637742
C -12.424137 0.370213 0.070220
C -0.820190 -0.192620 0.157579
C -13.603696 1.116271 -0.590164
C 1.555198 -0.759922 0.508786
C 2.005118 0.285054 -0.338515
C 2.501725 -1.611778 1.134511
C 4.353515 -0.374877 0.070283
C 3.388073 0.463363 -0.548100
C 3.874129 -1.417170 0.917342
C 5.809156 -0.173494 -0.153554
C 6.301162 0.354828 -1.382326
C 6.762082 -0.500849 0.854392
C 7.675681 0.552480 -1.597842
C 8.139733 -0.312124 0.650079
C 8.614351 0.219691 -0.581432
C 10.022623 0.417859 -0.796051
H -7.391197 -1.233197 0.163134
H -7.346275 -0.034692 1.472999
H -5.813635 1.428832 0.088980
H -5.867846 0.242962 -1.232510
H -8.381327 1.690390 -0.073733
H -8.428885 0.487602 -1.379621
H -4.829171 -1.500229 0.281428
H -4.781614 -0.323300 1.610634
H -9.954875 -0.973379 0.026146
H -9.912606 0.236346 1.325779
H -3.249302 1.159552 0.255515
H -3.309953 0.000986 -1.091635
H -10.992993 0.736289 -1.532489
H -10.950616 1.947081 -0.233894
H -2.217742 -0.638633 1.741717
H -2.263998 -1.780851 0.379471
H -12.517265 -0.717931 -0.124373
H -12.476347 0.493950 1.171393
H -0.730976 -0.270923 -0.946255
H -0.667734 0.866329 0.453680
H -13.551336 2.202031 -0.383193
H -13.590090 0.984415 -1.688751
H -14.577355 0.747987 -0.217608
H 1.297757 0.963500 -0.823628
H 2.135779 -2.420553 1.774034
H 3.718345 1.296440 -1.178864
H 4.585148 -2.106712 1.385328
H 5.599328 0.584305 -2.190956
H 6.416930 -0.879493 1.822191
H 8.033758 0.952189 -2.551896
H 8.854750 -0.562238 1.440231


