%chk=000146742.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146742

0 1
 N   -3.243600     -0.5807000      0.4112000    
 N  -0.3623000     -0.2730000      -1.634100    
 N    2.892800      0.5815000      0.8638000    
 C   -3.120900      -1.189800     -0.8849000    
 C   -2.792100     -0.1772000      -1.979800    
 C   -1.492000      0.5881000      -1.741400    
 C   0.7417000      1.6600000E-02 -0.7877000    
 C   -3.560200      -1.578900       1.444900    
 C   -4.272200      0.4713000      0.4143000    
 C   0.9571000       1.328800     -0.3542000    
 C    1.602900      -1.012800     -0.3945000    
 C    2.060300       1.569300      0.4821000    
 C    2.680700     -0.6807000      0.4435000    
 C   -2.520300      -2.686000       1.475900    
 C   -4.337200       1.171600       1.761000    
 C   0.1076000       2.382700     -0.7336000    
 C    1.410200      -2.340300     -0.8150000    
 C    2.280100       2.873600      0.9170000    
 C    3.541700      -1.701200      0.8384000    
 C   0.3493000       3.677700     -0.2850000    
 C    2.285300      -3.342100     -0.4060000    
 C    1.438000       3.923300      0.5420000    
 C    3.353100      -3.021600      0.4223000    
 H   -2.323100      -1.939500     -0.9072000    
 H   -4.044700      -1.713700      -1.165600    
 H   -2.688700     -0.7408000      -2.918200    
 H   -3.618700      0.5173000      -2.165400    
 H   -1.394800       1.225500      -2.628100    
 H   -1.730800       1.117300     -0.8164000    
 H   -3.535900      -1.123400       2.440000    
 H   -4.556900      -2.014200       1.299200    
 H   -4.036500       1.261200     -0.3042000    
 H   -5.260700      7.3600002E-02  0.1520000    
 H  -0.3382000      -1.107400      -2.204900    
 H   -2.625000      -3.382400      0.6381000    
 H   -1.500300      -2.286300       1.483500    
 H   -2.644000      -3.278900       2.389300    
 H   -4.829200      0.5644000       2.526800    
 H   -3.342000       1.459500       2.117300    
 H   -4.927500       2.090500       1.667900    
 H  -0.5965000       2.449100      -1.536800    
 H   0.5847000      -2.645300      -1.450500    
 H    3.128200       3.092100       1.563500    
 H    4.385800      -1.475400       1.487600    
 H  -0.2737000       4.502600     -0.6187000    
 H    2.132800      -4.367300     -0.7292000    
 H    1.643000       4.932300      0.8876000    
 H    4.041500      -3.796000      0.7481000    


%chk=000146742-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000146742

0 1
N -3.500258 -0.517788 0.386604
N -0.365967 -0.115670 -1.821294
N 2.835179 0.138277 1.039748
C -3.080940 -1.301813 -0.803602
C -2.826717 -0.399868 -2.036269
C -1.663904 0.593301 -1.820329
C 0.692909 0.014901 -0.930323
C -3.100296 -1.150756 1.676496
C -4.946791 -0.162547 0.350603
C 1.023395 1.256321 -0.277071
C 1.516081 -1.143089 -0.647948
C 2.080996 1.240932 0.731351
C 2.579616 -1.012264 0.338146
C -1.595912 -1.023575 1.979858
C -5.278933 1.100424 1.168352
C 0.421598 2.523457 -0.602744
C 1.318113 -2.426629 -1.264458
C 2.389884 2.460009 1.433718
C 3.407006 -2.155320 0.624535
C 0.772476 3.690780 0.072453
C 2.138013 -3.514856 -0.964331
C 1.749199 3.654738 1.122765
C 3.200508 -3.375548 -0.011699
H -2.145735 -1.835745 -0.554592
H -3.833680 -2.085330 -1.069747
H -2.632624 -1.034424 -2.927682
H -3.737926 0.184473 -2.268397
H -1.692066 1.371899 -2.610321
H -1.816706 1.078249 -0.840849
H -3.662421 -0.644054 2.481766
H -3.405696 -2.227922 1.708545
H -5.226053 0.019882 -0.704072
H -5.580511 -1.017811 0.698628
H -0.361977 -0.962722 -2.391581
H -0.968064 -1.551178 1.239906
H -1.293546 0.038076 1.983245
H -1.368943 -1.456791 2.971662
H -5.047370 0.970965 2.240688
H -4.692135 1.959149 0.798061
H -6.355052 1.342561 1.085845
H -0.295863 2.588046 -1.423404
H 0.508552 -2.585935 -1.988289
H 3.167809 2.399343 2.201058
H 4.200701 -2.012390 1.364386
H 0.310148 4.643466 -0.208175
H 1.965972 -4.481054 -1.451171
H 2.005389 4.575270 1.659247
H 3.841342 -4.234437 0.216584


