%chk=000091109.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091109

0 1
 O   -2.226600       1.037200     -0.6260000    
 O  -0.8473000      -2.457000       1.379000    
 O   -2.536200     -0.2688000       1.244500    
 N    2.318300      0.6462000     -8.0600001E-02
 C    1.071400      6.3000000E-03  0.3271000    
 C   0.2389000     -0.3586000     -0.9064000    
 C   -1.099900      -1.039600     -0.5721000    
 C    3.105100     -0.2531000     -0.9255000    
 C    3.094800       1.052400       1.091400    
 C  -0.8550000      -2.363300      0.1516000    
 C   -2.043600     -7.9999998E-02  0.1401000    
 C    4.376500      0.4222000      -1.411100    
 C    2.295000       1.987400       1.982700    
 C  -0.6563000      -3.584400     -0.7115000    
 C   -3.068200       2.045900     -5.8400001E-02
 C   -3.167000       3.206900      -1.024900    
 H   0.4555000      0.6852000      0.9240000    
 H    1.274700     -0.8821000      0.9367000    
 H   6.6600002E-02  0.5384000      -1.514900    
 H   0.7637000      -1.074600      -1.544900    
 H   -1.614700      -1.297000      -1.508500    
 H    3.351700      -1.191500     -0.4134000    
 H    2.576300     -0.5053000      -1.847500    
 H    3.436800      0.1894000       1.676600    
 H    3.981100       1.619300      0.7884000    
 H    4.177400       1.419600      -1.818200    
 H    5.133800      0.5030000     -0.6252000    
 H    4.825600     -0.1734000      -2.214200    
 H    1.812500       2.785800       1.408500    
 H    1.537500       1.460400       2.571100    
 H    2.966600       2.467400       2.703900    
 H  -0.4541000      -4.453000     -7.8299999E-02
 H   0.1956000      -3.433700      -1.378300    
 H   -1.562300      -3.773700      -1.292200    
 H   -2.638000       2.388900      0.8891000    
 H   -4.065400       1.629800      0.1237000    
 H   -3.578600       2.875800      -1.984000    
 H   -2.174700       3.621600      -1.231100    
 H   -3.804100       3.998800     -0.6214000    


%chk=000091109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091109

0 1
O -2.515763 0.792055 -0.671444
O 0.545005 -2.849510 -1.191873
O -1.772405 -0.424730 1.170705
N 2.721797 0.528217 0.064117
C 1.331460 0.041021 0.248878
C 0.593732 -0.018697 -1.109065
C -0.759566 -0.792124 -1.070223
C 3.651731 -0.559656 -0.353130
C 3.233762 1.315117 1.216521
C -0.551275 -2.317424 -0.876662
C -1.713192 -0.171961 -0.056529
C 4.832830 -0.044545 -1.197683
C 2.632311 2.731738 1.290573
C -1.722316 -3.138625 -0.368001
C -3.442185 1.552810 0.228183
C -4.176443 2.560880 -0.648905
H 0.799815 0.729008 0.929879
H 1.307692 -0.962687 0.736101
H 0.428143 1.007920 -1.481225
H 1.233510 -0.539747 -1.842848
H -1.231853 -0.676566 -2.068324
H 4.036534 -1.120256 0.535907
H 3.074850 -1.291589 -0.948113
H 3.065108 0.780843 2.186479
H 4.329070 1.405905 1.097498
H 4.457748 0.453155 -2.108969
H 5.449936 0.686284 -0.643000
H 5.491180 -0.882500 -1.495024
H 2.847467 3.282911 0.358480
H 1.535578 2.706226 1.426139
H 3.061238 3.291052 2.143262
H -1.528382 -4.210368 -0.526913
H -2.665504 -2.843897 -0.865230
H -1.857116 -2.943920 0.712585
H -2.837493 2.033859 1.017974
H -4.124565 0.829755 0.710602
H -4.755219 2.051078 -1.437916
H -3.467047 3.254832 -1.131016
H -4.876776 3.152938 -0.031988


