%chk=000042402.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042402

0 1
 N   0.3899000     -4.6399999E-02 -0.2128000    
 N   -4.435400     -0.1618000      0.5744000    
 C    1.346400      0.9683000     -6.9700003E-02
 C  -0.8387000      0.5615000     -0.4155000    
 C   0.6843000       2.197100     -0.2285000    
 C  -0.6854000       1.923000     -0.4307000    
 C    2.742200      0.9239000      0.1449000    
 C   0.5894000      -1.467400     -0.1929000    
 C    3.520900     -0.3483000      0.3179000    
 C   -2.165400     -0.1094000     -0.4154000    
 C    2.765100      -1.337800       1.189200    
 C    1.700500      -2.077600      0.4201000    
 C    1.410700       3.403400     -0.1700000    
 C   -3.150900      0.5303000      0.5737000    
 C    3.438000       2.150300      0.1715000    
 C   -1.760000       2.925000     -0.6006000    
 C  -0.3743000      -2.285100     -0.8199000    
 C    2.787500       3.367600      2.4200000E-02
 C    1.810400      -3.485000      0.3815000    
 C  -0.2416000      -3.674400     -0.8473000    
 C   0.8524000      -4.275900     -0.2469000    
 C   -5.065200     -7.8900002E-02 -0.7442000    
 C   -5.320900      0.3977000       1.596700    
 H    3.761700     -0.7676000     -0.6664000    
 H    4.472400     -0.1222000      0.8157000    
 H   -2.543800     -9.7199999E-02  -1.442400    
 H   -2.147400      -1.133300     -4.8700001E-02
 H    2.312300     -0.8568000       2.066100    
 H    3.495300      -2.054500       1.587200    
 H   0.9112000       4.361400     -0.2856000    
 H   -3.363200       1.577400      0.3862000    
 H   -2.708600      0.4771000       1.578400    
 H    4.516700       2.155200      0.3193000    
 H   -1.362800       3.820200      -1.094300    
 H   -2.564400       2.574400      -1.254600    
 H   -2.153400       3.256800      0.3650000    
 H   -1.134500      -1.903000      -1.492700    
 H    3.353700       4.293800      5.9200000E-02
 H    2.655500      -3.982400      0.8538000    
 H  -0.9707000      -4.279200      -1.378800    
 H   0.9664000      -5.355300     -0.2716000    
 H   -5.127500      0.9503000      -1.116200    
 H   -6.085500     -0.4799000     -0.7044000    
 H   -4.547800     -0.6977000      -1.483300    
 H   -4.865700      0.3128000       2.589900    
 H   -6.262600     -0.1611000       1.637500    
 H   -5.554100       1.452700       1.412400    


%chk=000042402-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042402

0 1
N 0.290006 0.027648 -0.282610
N -4.301840 -0.328141 0.720125
C 1.316322 1.006407 -0.152081
C -0.894774 0.686565 -0.751482
C 0.775221 2.256078 -0.609661
C -0.614059 2.036151 -0.966290
C 2.631634 0.902776 0.368594
C 0.506717 -1.392747 -0.334733
C 3.184453 -0.361005 1.013334
C -2.258656 0.038341 -0.722211
C 2.083563 -1.243230 1.677839
C 1.322668 -2.041446 0.636919
C 1.581878 3.420962 -0.613559
C -3.000843 0.369371 0.604913
C 3.405172 2.089017 0.355483
C -1.573289 3.106178 -1.419015
C -0.063902 -2.147426 -1.393916
C 2.905048 3.322595 -0.143000
C 1.495505 -3.443506 0.543523
C 0.113436 -3.544089 -1.460965
C 0.886565 -4.203490 -0.479187
C -5.328734 0.200029 -0.200079
C -4.787862 -0.372784 2.114813
H 3.728676 -0.981297 0.273126
H 3.927231 -0.063180 1.777422
H -2.848764 0.402208 -1.583592
H -2.213886 -1.059164 -0.799028
H 1.403824 -0.587501 2.255651
H 2.559172 -1.939164 2.392335
H 1.178314 4.377936 -0.962514
H -3.111240 1.480769 0.699098
H -2.360935 0.037353 1.443989
H 4.419757 2.052807 0.771603
H -1.170011 3.654658 -2.291976
H -2.550185 2.684831 -1.712421
H -1.757615 3.856319 -0.625006
H -0.610315 -1.628129 -2.186622
H 3.550982 4.207658 -0.129483
H 2.123443 -3.942747 1.291448
H -0.335313 -4.108129 -2.285845
H 1.029368 -5.288550 -0.520520
H -5.571104 1.278759 -0.014192
H -6.259647 -0.383869 -0.087369
H -4.997949 0.099384 -1.247957
H -4.030202 -0.855764 2.757031
H -5.712753 -0.975367 2.166696
H -5.011976 0.637925 2.542774


