%chk=000081729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081729

0 1
 O    3.044500      0.2573000      9.3000000E-03
 O   -3.044500     -0.2576000      1.9000000E-03
 N    7.885200      0.4345000      3.8999999E-03
 N   -7.885200     -0.4341000      9.7000003E-03
 C   0.6538000      0.3918000      3.3300001E-02
 C  -0.6538000     -0.3922000      1.8900000E-02
 C    1.863100     -0.5320000      9.3999999E-03
 C   -1.863100      0.5319000     -5.0000002E-04
 C    4.213100     -0.5515000     -1.2500000E-02
 C   -4.213000      0.5514000     -1.5799999E-02
 C    5.438000      0.3531000     -1.1400000E-02
 C   -5.438100     -0.3529000     -1.2400000E-02
 C    6.731100     -0.4559000     -1.8700000E-02
 C   -6.731100      0.4562000     -1.5000000E-02
 H   0.6998000       1.069100     -0.8287000    
 H   0.7029000       1.033600      0.9218000    
 H  -0.7115000      -1.049900      0.8952000    
 H  -0.6912000      -1.053900     -0.8556000    
 H    1.840400      -1.157300     -0.8909000    
 H    1.855800      -1.182600      0.8918000    
 H   -1.853900       1.180400      0.8834000    
 H   -1.842200       1.159100     -0.8995000    
 H    4.209700      -1.177600     -0.9125000    
 H    4.225200      -1.201200      0.8705000    
 H   -4.212000       1.178600     -0.9151000    
 H   -4.222600       1.200100      0.8680000    
 H    5.395500       1.019400     -0.8828000    
 H    5.401200       1.008600      0.8685000    
 H   -5.398100      -1.018200     -0.8848000    
 H   -5.398700      -1.009500      0.8666000    
 H    6.777500      -1.088500     -0.9119000    
 H    6.770300      -1.112000      0.8574000    
 H   -6.779900       1.090000     -0.9073000    
 H   -6.767800       1.111200      0.8619000    
 H    8.739600     -0.1181000     -5.3599998E-02
 H    7.874800       1.031300     -0.8222000    
 H   -8.739700      0.1187000     -4.4799998E-02
 H   -7.877300      -1.029900     -0.8173000    


%chk=000081729-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081729

0 1
O 3.095569 0.197161 -0.010326
O -3.095690 -0.197228 -0.010143
N 7.985362 0.489571 -0.032855
N -7.985511 -0.489391 -0.033343
C 0.678915 0.369079 -0.007817
C -0.679032 -0.369189 -0.009100
C 1.863606 -0.601533 -0.007838
C -1.863715 0.601427 -0.005485
C 4.305169 -0.635214 -0.005801
C -4.305267 0.635170 -0.003882
C 5.515467 0.303225 -0.002757
C -5.515599 -0.303231 -0.002892
C 6.855223 -0.460984 -0.040069
C -6.855320 0.461117 -0.038641
H 0.762074 1.024802 -0.896274
H 0.761473 1.023224 0.881763
H -0.761523 -1.026546 0.878121
H -0.762261 -1.021696 -0.899912
H 1.834010 -1.258976 -0.907255
H 1.835647 -1.256133 0.893506
H -1.835424 1.253026 0.898026
H -1.834421 1.261863 -0.902714
H 4.314354 -1.293799 -0.905337
H 4.311495 -1.290758 0.895482
H -4.314376 1.295677 -0.902006
H -4.311628 1.288786 0.898803
H 5.440286 0.974749 -0.881530
H 5.489683 0.942485 0.897421
H -5.440407 -0.972889 -0.883088
H -5.489887 -0.944397 0.895929
H 6.850931 -1.153309 -0.919880
H 6.937720 -1.095532 0.864208
H -6.851008 1.155227 -0.917040
H -6.937776 1.093823 0.866931
H 8.907406 0.053273 0.061739
H 7.959039 1.164768 -0.804023
H -8.907527 -0.053233 0.062167
H -7.959254 -1.163016 -0.805889


