%chk=000026206.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026206

0 1
 O    3.387400       2.906400      5.9200000E-02
 N   -1.051100     -0.3105000      0.1511000    
 N    3.027800      -2.345400     -0.2211000    
 C   0.8722000      -1.377800      0.4486000    
 C    1.153300      7.1000000E-03  0.2813000    
 C  -0.4911000      -1.541600      0.3635000    
 C  -7.0400000E-02  0.6542000      9.6799999E-02
 C    1.865800      -2.449100      0.6719000    
 C   -2.422500     -7.0000000E-02  9.6000005E-03
 C    2.334900      0.7746000      0.2694000    
 C  -0.1719000       2.036000     -9.9699996E-02
 C   -1.300700      -2.777000      0.4670000    
 C    2.248700       2.157800      7.3799998E-02
 C    1.013500       2.776700     -0.1077000    
 C   -2.994900     -0.1162000      -1.252500    
 C   -3.184200      0.2102000       1.133900    
 C    2.601900      -2.430400      -1.615100    
 C    3.996700      -3.393100      8.7899998E-02
 C   -4.361700      0.1231000      -1.393600    
 C   -4.551100      0.4496000      0.9926000    
 C   -5.139900      0.4060000     -0.2711000    
 C    3.237500       4.309500     -0.1459000    
 H    2.205000      -2.369900       1.713500    
 H    1.411200      -3.441400      0.5684000    
 H    3.306900      0.3135000      0.4192000    
 H   -1.129300       2.526500     -0.2420000    
 H   -1.642900      -3.092800     -0.5239000    
 H  -0.7353000      -3.605100      0.9034000    
 H   -2.177600      -2.633900       1.106400    
 H   0.8937000       3.844200     -0.2629000    
 H   -2.399100     -0.3359000      -2.134600    
 H   -2.736900      0.2467000       2.123800    
 H    1.980700      -1.583500      -1.922500    
 H    3.475300      -2.404500      -2.277900    
 H    2.053300      -3.356500      -1.825200    
 H    4.886600      -3.292200     -0.5434000    
 H    4.339700      -3.308200       1.125200    
 H    3.584500      -4.398300     -5.7900000E-02
 H   -4.820300      8.9199997E-02  -2.377600    
 H   -5.157000      0.6699000       1.866700    
 H   -6.204300      0.5924000     -0.3811000    
 H    4.241100       4.747000     -0.1283000    
 H    2.672300       4.778000      0.6670000    
 H    2.811600       4.530200      -1.130600    


%chk=000026206-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026206

0 1
O 3.451129 2.934514 0.312886
N -1.111684 -0.306890 0.090686
N 3.046881 -2.427905 -0.409045
C 0.907092 -1.376483 0.359309
C 1.151887 0.054816 0.298732
C -0.472397 -1.571828 0.225816
C -0.119449 0.703423 0.139686
C 1.954991 -2.431026 0.605264
C -2.519372 -0.070081 -0.035089
C 2.333963 0.828774 0.347120
C -0.224978 2.101463 0.017928
C -1.265546 -2.848884 0.277974
C 2.226080 2.232023 0.247583
C 0.959727 2.868516 0.079513
C -3.270818 -0.707417 -1.055183
C -3.167113 0.822527 0.858022
C 2.561249 -2.675988 -1.779450
C 4.140854 -3.340689 -0.028058
C -4.657574 -0.467274 -1.167072
C -4.550684 1.070090 0.729985
C -5.303458 0.423753 -0.278773
C 3.402871 4.388499 0.184748
H 2.439286 -2.250387 1.586888
H 1.469344 -3.440478 0.669534
H 3.316515 0.357206 0.426660
H -1.190734 2.594461 -0.129958
H -1.599086 -3.185813 -0.722325
H -0.648990 -3.655129 0.707266
H -2.170930 -2.740215 0.902381
H 0.889624 3.956317 -0.011242
H -2.763542 -1.367872 -1.765429
H -2.586871 1.297901 1.655486
H 1.799359 -1.923200 -2.042656
H 3.401543 -2.582347 -2.490438
H 2.106758 -3.693430 -1.908259
H 4.969135 -3.251687 -0.753554
H 4.528178 -3.063463 0.969336
H 3.831075 -4.417995 0.009823
H -5.229694 -0.964298 -1.958335
H -5.042888 1.758354 1.426072
H -6.378054 0.613938 -0.372470
H 4.450215 4.718849 0.256722
H 2.812333 4.851746 1.000643
H 2.983176 4.699110 -0.793129


