%chk=000145765.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145765

0 1
 N  -0.3764000      0.2581000     -0.2198000    
 N   -4.754100      0.1867000     -0.2429000    
 C    2.406800     -0.5793000     -0.1013000    
 C    1.228800      -1.570900     -1.9600000E-02
 C    1.973100      0.8992000     -4.3600000E-02
 C  -0.1091000      -1.119600     -6.0300000E-02
 C   0.6083000       1.261500     -8.3600000E-02
 C    3.365000     -0.8565000       1.089900    
 C    3.150700     -0.8163000      -1.435800    
 C   -1.748300      0.6684000     -0.5421000    
 C    1.481300      -2.959100      7.6600000E-02
 C    2.950800       1.918300      3.0200001E-02
 C   -2.573200      0.8454000      0.7323000    
 C   -1.136500      -2.079500      7.6200001E-02
 C   0.2829000       2.631400      3.0200001E-02
 C   0.4474000      -3.884900      0.1822000    
 C    2.601000       3.263000      0.1139000    
 C  -0.8638000      -3.442800      0.1947000    
 C    1.263900       3.619000      0.1266000    
 C   -4.039400       1.220400      0.4958000    
 C   -6.158900      0.5372000     -0.3998000    
 H    2.856200     -0.6936000       2.048400    
 H    3.748400      -1.882000       1.093000    
 H    4.251400     -0.2140000       1.076600    
 H    3.516400      -1.845500      -1.525700    
 H    2.493600     -0.6268000      -2.293800    
 H    4.023400     -0.1620000      -1.542000    
 H   -1.772700       1.585000      -1.144800    
 H   -2.216400     -6.4499997E-02  -1.211800    
 H    2.499100      -3.340700      6.8300001E-02
 H    4.010000       1.674100      2.1199999E-02
 H   -2.125600       1.632800       1.351300    
 H   -2.538000     -5.3500000E-02   1.358300    
 H   -2.186900      -1.806100      7.2600000E-02
 H  -0.7462000       2.978400      4.7499999E-02
 H   0.6695000      -4.944700      0.2602000    
 H    3.371900       4.024800      0.1762000    
 H   -1.679300      -4.154300      0.2846000    
 H   0.9775000       4.663700      0.2046000    
 H   -4.078000       2.168800     -5.3500000E-02
 H   -4.514000       1.383600       1.471300    
 H   -4.680700     -0.7009000      0.2533000    
 H   -6.668500     -0.2475000     -0.9674000    
 H   -6.274400       1.473000     -0.9562000    
 H   -6.660800      0.6314000      0.5688000    


%chk=000145765-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145765

0 1
N -0.318959 0.407948 -0.310028
N -4.542593 -0.123781 -0.016584
C 2.372823 -0.600035 -0.207187
C 1.175685 -1.491382 0.174076
C 2.053391 0.854041 0.187701
C -0.146375 -0.972425 -0.006075
C 0.713852 1.329522 0.013258
C 3.701948 -1.101497 0.404508
C 2.507421 -0.641743 -1.772368
C -1.672339 0.906970 -0.632380
C 1.322729 -2.840791 0.564252
C 3.048818 1.771571 0.590004
C -2.559685 1.245486 0.598519
C -1.267482 -1.840466 0.128375
C 0.440399 2.716847 0.177529
C 0.210535 -3.697119 0.728437
C 2.771835 3.145258 0.774542
C -1.084160 -3.192444 0.483734
C 1.462113 3.615676 0.543936
C -4.056352 1.255594 0.223409
C -5.886748 -0.211053 -0.623167
H 3.671715 -1.096275 1.508960
H 3.926502 -2.127238 0.064557
H 4.547542 -0.474162 0.073083
H 2.705170 -1.675909 -2.109895
H 1.580448 -0.291119 -2.259043
H 3.339007 0.008973 -2.100357
H -1.568862 1.798572 -1.277238
H -2.193518 0.141742 -1.231810
H 2.326170 -3.245993 0.725408
H 4.071937 1.416872 0.745984
H -2.278624 2.225171 1.026909
H -2.384467 0.496686 1.395581
H -2.283795 -1.472269 -0.042105
H -0.571730 3.104427 0.040356
H 0.357053 -4.741528 1.023654
H 3.567719 3.833162 1.078607
H -1.959761 -3.845301 0.577881
H 1.225437 4.679142 0.663397
H -4.202569 1.830332 -0.714069
H -4.641545 1.788285 1.013042
H -4.477934 -0.684375 0.844920
H -6.178326 -1.270930 -0.728077
H -5.861702 0.230518 -1.636510
H -6.686524 0.314240 -0.046926


