%chk=000097542.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097542

0 1
 O  -0.8631000      0.4523000      0.1282000    
 O   -7.195300      -1.448100      0.3607000    
 O   -5.520900      -2.525400     -0.5640000    
 O    7.590800     -0.6139000      0.7984000    
 O    7.346900     -3.9500002E-02  -1.306300    
 N   -6.018600      -1.482700     -7.4199997E-02
 N   0.4471000      0.4439000     -0.3697000    
 N    6.867500     -0.2841000     -0.1727000    
 C   -3.145600      0.8352000     -0.4195000    
 C   -1.734900      0.8196000     -0.9302000    
 C   -3.915300     -0.3209000     -0.4865000    
 C   -3.670200       2.005700      0.1174000    
 C   -5.226400     -0.3063000     -1.0300000E-02
 C   -4.981100       2.020300      0.5934000    
 C   -5.759200      0.8644000      0.5298000    
 C    2.706100      8.7000001E-03  0.3901000    
 C    5.464000     -0.1854000      1.7000001E-02
 C    3.529800     -0.3562000       1.454700    
 C    3.261200      0.2766000     -0.8613000    
 C    4.908700     -0.4530000       1.268300    
 C    4.640100      0.1796000      -1.047900    
 C    1.268400      0.1092000      0.5844000    
 H   -1.637200      0.1065000      -1.758800    
 H   -1.458600       1.810000      -1.314000    
 H   -3.476200      -1.221400     -0.9093000    
 H   -3.072200       2.911000      0.1741000    
 H   -5.395400       2.931800       1.014400    
 H   -6.776100      0.9130000      0.9105000    
 H    3.111500     -0.5680000       2.435400    
 H    2.643500      0.5629000      -1.708500    
 H    5.519600     -0.7399000       2.120500    
 H    5.037700      0.3954000      -2.036300    
 H   0.8803000     -0.1132000       1.595400    


%chk=000097542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097542

0 1
O -0.855541 0.006019 0.192926
O -7.881192 -0.522666 -0.284361
O -6.514334 -1.575214 -1.775828
O 7.823613 -0.116482 0.764645
O 7.473327 0.583782 -1.379840
N -6.723353 -0.745478 -0.808881
N 0.499015 0.161175 -0.307786
N 7.049757 0.197332 -0.221736
C -3.172375 0.472191 -0.319341
C -1.800707 0.272119 -0.925832
C -4.283106 -0.235774 -0.824945
C -3.360460 1.391161 0.746988
C -5.557552 0.000079 -0.266074
C -4.642965 1.604058 1.297720
C -5.762401 0.910071 0.791602
C 2.807415 -0.051824 0.385073
C 5.585828 0.109341 -0.011847
C 3.708203 -0.387457 1.435778
C 3.331699 0.366241 -0.874574
C 5.099251 -0.309172 1.245611
C 4.717297 0.447903 -1.077252
C 1.364486 -0.147494 0.636568
H -1.784331 -0.582301 -1.626359
H -1.446881 1.175470 -1.457368
H -4.184737 -0.963313 -1.636189
H -2.493805 1.927008 1.148272
H -4.773107 2.312828 2.121556
H -6.768690 1.054823 1.193001
H 3.312274 -0.710848 2.405166
H 2.636538 0.622062 -1.679480
H 5.807122 -0.561510 2.039166
H 5.143170 0.765271 -2.032607
H 1.023443 -0.481301 1.629430


