%chk=000060511.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060511

0 1
 O   -3.173600      0.4015000     -9.9399999E-02
 N   -1.077000       1.232100      0.4630000    
 N   -3.862700       2.654300      -1.412800    
 C  -0.6051000      8.2199998E-02   1.200500    
 C   0.7989000      0.3943000       1.801900    
 C  -0.5536000      -1.181200      0.3259000    
 C   -1.600900     -0.1022000       2.368300    
 C    1.904300      0.6417000      0.7971000    
 C  -0.7943000      -2.394900      0.9198000    
 C  -0.2697000      -1.038300      -1.009400    
 C   -2.330700       1.294700     -0.1288000    
 C    2.659200     -0.4274000      0.3477000    
 C    2.134400       1.931000      0.3506000    
 C  -0.7479000      -3.541200      0.1264000    
 C  -0.2234000      -2.184700      -1.802700    
 C   -2.549800       2.622100     -0.8204000    
 C  -0.4624000      -3.436100      -1.234700    
 C    3.677500     -0.1997000     -0.5781000    
 C    3.152600       2.158600     -0.5753000    
 C    3.924100       1.093200      -1.039600    
 H    1.112300     -0.4296000       2.459300    
 H   0.7300000       1.271300       2.462100    
 H   -2.566100     -0.5198000       2.062500    
 H   -1.198300     -0.7551000       3.152100    
 H   -1.806900      0.8582000       2.859300    
 H  -0.4877000       2.056100      0.4094000    
 H  -0.9945000      -2.525200       1.976100    
 H  -6.7800000E-02 -8.0100000E-02  -1.476300    
 H    2.483700      -1.437300      0.7065000    
 H    1.552700       2.772400      0.7142000    
 H  -0.9279000      -4.516500      0.5692000    
 H   2.3000001E-03  -2.103500      -2.861900    
 H   -1.780400       2.758600      -1.587500    
 H   -2.453600       3.424400     -8.1400000E-02
 H  -0.4240000      -4.328800      -1.852000    
 H    4.279400      -1.029000     -0.9381000    
 H    3.347100       3.165800     -0.9321000    
 H    4.717700       1.270700      -1.759500    
 H   -3.933300       1.944900      -2.141400    
 H   -4.007100       3.549800      -1.877700    


%chk=000060511-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060511

0 1
O -3.289112 0.807266 -0.099526
N -0.997170 1.141441 0.278111
N -3.534850 3.226043 -1.347897
C -0.698277 -0.021841 1.152629
C 0.707597 0.268893 1.820867
C -0.641299 -1.346878 0.350709
C -1.749714 -0.110439 2.294803
C 1.820861 0.683457 0.869007
C -0.485068 -2.579525 1.039113
C -0.706311 -1.375572 -1.062568
C -2.215518 1.457116 -0.287890
C 2.525040 -0.273455 0.089790
C 2.177847 2.053233 0.739692
C -0.395158 -3.800496 0.336836
C -0.619059 -2.595613 -1.770798
C -2.181650 2.687964 -1.222862
C -0.461488 -3.815080 -1.076013
C 3.546685 0.129867 -0.797466
C 3.200620 2.460172 -0.148887
C 3.886488 1.497794 -0.923660
H 0.993225 -0.645600 2.370068
H 0.547778 1.066322 2.571478
H -2.736764 -0.380040 1.891416
H -1.442937 -0.859925 3.045057
H -1.833843 0.868322 2.800077
H -0.191802 1.718501 0.014165
H -0.437677 -2.595926 2.134403
H -0.828370 -0.439837 -1.616488
H 2.269278 -1.335066 0.180179
H 1.670109 2.802820 1.361233
H -0.277641 -4.738723 0.891034
H -0.676689 -2.591361 -2.865212
H -1.741459 2.340155 -2.191210
H -1.477101 3.439813 -0.808146
H -0.395666 -4.761634 -1.623956
H 4.080656 -0.622804 -1.388402
H 3.465364 3.520592 -0.227983
H 4.682106 1.807435 -1.610433
H -4.245786 2.533485 -1.084163
H -3.735745 3.726424 -2.214308


