%chk=000088574.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088574

0 1
 O   0.4329000       1.408600     -7.4699998E-02
 N    6.228700     -0.1783000     -0.2369000    
 N    2.651100      0.8135000     -0.1349000    
 N   0.8761000     -0.8092000     -6.6100001E-02
 C    5.072100      0.7168000     -0.2389000    
 C    3.780000     -8.6000003E-02 -0.1595000    
 C  -0.7530000      0.7399000     -3.2800000E-02
 C  -0.4796000     -0.6053000     -2.7799999E-02
 C    1.348600      0.4085000     -9.2200004E-02
 C   -1.931200       1.557400     -5.5999998E-03
 C   -1.446800      -1.657800      1.1300000E-02
 C    6.232400      -1.005600      0.9691000    
 C    7.469500      0.5895000     -0.3338000    
 C   -3.124700       1.094400     -0.5699000    
 C   -1.897300       2.825000      0.5856000    
 C   -1.959100      -2.187900      -1.176500    
 C   -1.886200      -2.163500       1.238100    
 C   -4.270600       1.889300     -0.5430000    
 C   -3.043200       3.619800      0.6123000    
 C   -2.902400      -3.214700      -1.137700    
 C   -2.829600      -3.190400       1.276900    
 C   -4.230000       3.152000      4.8000000E-02
 C   -3.337700      -3.715900      8.9000002E-02
 H    5.064500       1.308100      -1.164000    
 H    5.122800       1.431600      0.5941000    
 H    3.724600     -0.6880000      0.7522000    
 H    3.700200     -0.7616000      -1.019900    
 H    2.851600       1.810200     -0.1491000    
 H    5.472300      -1.791800      0.9286000    
 H    6.102000     -0.4172000       1.884800    
 H    7.183700      -1.545100       1.057600    
 H    8.334500     -8.0600001E-02 -0.3926000    
 H    7.609700       1.259900      0.5220000    
 H    7.479500       1.191800      -1.249100    
 H   -3.199500      0.1376000      -1.070300    
 H  -0.9883000       3.212700       1.039700    
 H   -1.629500      -1.810600      -2.142000    
 H   -1.500700      -1.765500       2.174100    
 H   -5.192900       1.528600     -0.9892000    
 H   -3.012100       4.602600       1.073700    
 H   -3.297900      -3.624100      -2.062600    
 H   -3.168600      -3.580700       2.232100    
 H   -5.121700       3.771500      6.7599997E-02
 H   -4.072200      -4.515400      0.1192000    


%chk=000088574-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088574

0 1
O 0.355562 2.007188 -0.490536
N 5.697299 -0.386431 -0.144702
N 2.628461 1.677780 -1.056992
N 1.116757 -0.161770 -0.555611
C 4.562157 0.536251 0.082277
C 3.827915 0.846081 -1.247978
C -0.761651 1.139811 -0.177599
C -0.265605 -0.167388 -0.198532
C 1.429623 1.122945 -0.710027
C -2.045111 1.820068 -0.016058
C -0.902711 -1.455578 0.135797
C 5.276173 -1.799245 -0.267932
C 6.787752 -0.227046 0.838631
C -3.277055 1.162941 -0.303247
C -2.083399 3.184883 0.394522
C -0.383512 -2.648061 -0.440061
C -1.979362 -1.557366 1.059742
C -4.502954 1.842319 -0.155852
C -3.312979 3.860343 0.533824
C -0.947871 -3.902512 -0.128488
C -2.538953 -2.813742 1.372966
C -4.531508 3.192908 0.266980
C -2.032299 -3.992533 0.775709
H 4.956391 1.481542 0.500813
H 3.820976 0.131613 0.813880
H 3.513628 -0.094855 -1.730649
H 4.520159 1.363294 -1.934462
H 2.688423 2.693529 -1.100360
H 4.489419 -1.902947 -1.033709
H 4.874282 -2.217009 0.689033
H 6.138099 -2.415685 -0.580460
H 7.642285 -0.864468 0.546819
H 6.494143 -0.507198 1.882197
H 7.134470 0.821649 0.848803
H -3.269932 0.128986 -0.661795
H -1.142859 3.705100 0.601208
H 0.467984 -2.568805 -1.122932
H -2.362564 -0.657153 1.551116
H -5.438572 1.320049 -0.385581
H -3.320863 4.908589 0.853375
H -0.540060 -4.810616 -0.586896
H -3.363660 -2.874239 2.092188
H -5.486605 3.717932 0.377698
H -2.469876 -4.967055 1.019778


