%chk=000174449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000174449

0 1
 N    3.128000       1.470000      7.9300001E-02
 N   -4.743000      -1.551500     -0.3252000    
 N   -6.251900      0.1680000     -4.0500000E-02
 N   -4.966500      0.6771000      0.1101000    
 N   -2.790300     -0.1244000     -1.5200000E-02
 N   -2.436500       1.023400     -0.3487000    
 C    3.853300      0.6923000       1.063900    
 C    3.863000       2.354600     -0.8029000    
 C    1.726100       1.357500     -2.8300000E-02
 C    4.108400     -0.7141000      0.5908000    
 C   -6.156100      -1.297800     -0.1684000    
 C    1.150600      0.9331000      -1.226000    
 C   0.9154000       1.670800       1.062600    
 C    3.951800       3.741800     -0.1962000    
 C   -4.138200     -0.3346000     -8.6000003E-02
 C   -1.039400       1.135500     -0.2410000    
 C    3.178500      -1.707000      0.8663000    
 C    5.269700     -0.9981000     -0.1141000    
 C  -0.2357000      0.8219000      -1.332500    
 C  -0.4709000       1.559500      0.9559000    
 C   -4.164300      -2.862900     -0.3185000    
 C   -7.251100      0.6032000      0.9201000    
 C    3.414800      -3.009900      0.4281000    
 C    5.505900      -2.301100     -0.5523000    
 C    4.578500      -3.307100     -0.2812000    
 H    3.325500      0.6682000       2.026300    
 H    4.813500       1.172300       1.297500    
 H    4.877200       1.973300     -0.9696000    
 H    3.399300       2.418700      -1.793900    
 H   -6.720200      -1.643500      -1.040500    
 H   -6.523200      -1.812900      0.7275000    
 H    1.767500      0.6739000      -2.082500    
 H    1.345900       2.013600       1.999800    
 H    4.525500       4.406400     -0.8498000    
 H    4.445300       3.717400      0.7810000    
 H    2.957300       4.178900     -5.7700001E-02
 H    2.269400      -1.488100       1.419200    
 H    6.000200     -0.2237000     -0.3300000    
 H  -0.6758000      0.4886000      -2.268600    
 H   -1.095500       1.808500       1.809600    
 H   -4.005800      -3.205900      0.7085000    
 H   -4.819300      -3.579200     -0.8246000    
 H   -3.200700      -2.865800     -0.8375000    
 H   -6.996500      0.2899000       1.938400    
 H   -8.237200      0.2011000      0.6649000    
 H   -7.333800       1.695100      0.9116000    
 H    2.692700      -3.793200      0.6394000    
 H    6.412200      -2.532600      -1.104300    
 H    4.762500      -4.321600     -0.6224000    


%chk=000174449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174449

0 1
N 3.074941 1.274361 -0.012869
N -5.200400 -1.409937 0.758373
N -6.639581 -0.240626 -0.540109
N -5.376575 0.368496 -0.698014
N -3.162999 -0.244883 0.222792
N -2.574008 0.751707 -0.425884
C 3.898901 0.491467 0.920528
C 3.800114 2.257938 -0.844631
C 1.683820 1.129512 -0.084427
C 4.548826 -0.763540 0.322679
C -6.645982 -1.199512 0.600644
C 0.875279 2.052453 -0.826532
C 1.014377 0.034545 0.565453
C 3.922849 3.654823 -0.191867
C -4.536845 -0.353621 0.072334
C -1.172299 0.805039 -0.254544
C 4.008483 -1.402085 -0.820004
C 5.701130 -1.316392 0.937426
C -0.512962 1.884300 -0.909440
C -0.372950 -0.119122 0.486627
C -4.671732 -2.074813 1.943602
C -7.815234 0.566298 -0.838717
C 4.604697 -2.576395 -1.333928
C 6.296414 -2.491642 0.427411
C 5.748272 -3.126955 -0.711591
H 3.285309 0.213352 1.797957
H 4.697299 1.151495 1.314425
H 4.809070 1.848009 -1.039099
H 3.304346 2.336157 -1.829112
H -7.194225 -2.127970 0.343844
H -7.116394 -0.757846 1.529088
H 1.331396 2.910463 -1.327517
H 1.596179 -0.721915 1.101646
H 4.488273 4.339167 -0.851107
H 4.456799 3.595060 0.774129
H 2.929464 4.096494 -0.001574
H 3.125124 -0.977625 -1.309103
H 6.135990 -0.825140 1.817954
H -1.131281 2.588685 -1.476070
H -0.869602 -0.964471 0.973079
H -5.043243 -1.608642 2.884968
H -4.949380 -3.145113 1.952876
H -3.574106 -1.990464 1.919230
H -8.097969 1.234958 0.006254
H -8.672635 -0.090837 -1.069860
H -7.593351 1.189100 -1.718632
H 4.174922 -3.060962 -2.217855
H 7.187450 -2.906790 0.911995
H 6.210129 -4.036978 -1.110429


