%chk=000071754.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071754

0 1
 O    4.258200      -2.722500      -1.341600    
 O   -4.627100       1.914000     -0.9405000    
 O   -6.360000     -9.6299998E-02 -0.1146000    
 O    5.928200       3.085200      0.2893000    
 N    1.328100      -1.225500      0.4043000    
 C    2.075400      -1.923800     -0.6392000    
 C  -8.1500001E-02  -1.132600      5.5900000E-02
 C    3.577100      -2.009400     -0.3006000    
 C  -0.8671000     -0.3983000       1.143100    
 C   -2.334300     -0.3147000      0.8047000    
 C    4.198800     -0.6630000     -0.1448000    
 C   -2.805700      0.7709000      8.2300000E-02
 C   -3.187700      -1.324500       1.222500    
 C    4.833100     -0.3215000       1.049500    
 C    4.145200      0.2552000      -1.193500    
 C   -4.163000      0.8485000     -0.2298000    
 C   -4.545000      -1.246900      0.9106000    
 C   -5.032600     -0.1604000      0.1843000    
 C    5.413800      0.9384000       1.195200    
 C    4.726000       1.515000      -1.047800    
 C    5.360300       1.856600      0.1465000    
 C   -5.062100       3.049900     -0.1958000    
 C   -6.778100     -0.6944000      -1.340000    
 H    1.689900      -2.945100     -0.7582000    
 H    1.931600      -1.437300      -1.612200    
 H  -0.1960000     -0.5969000     -0.8951000    
 H  -0.5010000      -2.137200     -8.3600000E-02
 H    3.705300      -2.598800      0.6161000    
 H  -0.7453000     -0.9047000       2.110000    
 H  -0.4648000      0.6136000       1.285300    
 H    1.436600      -1.715400       1.291700    
 H   -2.129700       1.557000     -0.2438000    
 H   -2.817300      -2.175400       1.787000    
 H    4.882900      -1.025400       1.875900    
 H    3.666900      6.3000000E-03  -2.136700    
 H   -5.216800      -2.036400       1.236600    
 H    3.842600      -3.598500      -1.414800    
 H    5.905100       1.192200       2.130700    
 H    4.683600       2.225100      -1.869200    
 H   -5.408400       3.810000     -0.9013000    
 H   -5.892000       2.782400      0.4658000    
 H   -4.234600       3.465200      0.3881000    
 H    6.321300       3.149700       1.176600    
 H   -7.858000     -0.5543000      -1.438500    
 H   -6.563100      -1.767600      -1.335800    
 H   -6.284100     -0.2152000      -2.191100    


%chk=000071754-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071754

0 1
O 4.604835 -2.755664 -1.251513
O -4.132424 2.009291 -0.746277
O -6.292110 0.172587 -0.002141
O 5.270816 3.491937 -0.235281
N 1.377307 -1.871334 0.477934
C 2.260276 -2.257129 -0.632250
C -0.034874 -1.606638 0.134944
C 3.762258 -2.071607 -0.254339
C -0.787489 -1.011320 1.352516
C -2.235938 -0.679743 1.027449
C 4.188772 -0.612303 -0.220010
C -2.556232 0.504473 0.316509
C -3.294060 -1.546066 1.402507
C 3.912343 0.187198 0.914094
C 4.829966 -0.015817 -1.335413
C -3.887963 0.815065 -0.025392
C -4.629658 -1.255186 1.045899
C -4.937007 -0.087999 0.316331
C 4.257075 1.556616 0.937572
C 5.183030 1.348271 -1.324704
C 4.892558 2.134749 -0.187072
C -4.975549 2.997118 -0.032703
C -6.584227 0.220404 -1.454221
H 2.112865 -3.321027 -0.962166
H 2.035871 -1.617009 -1.504951
H -0.053362 -0.873156 -0.693291
H -0.582903 -2.512239 -0.225309
H 3.920571 -2.529388 0.749242
H -0.746648 -1.735063 2.191089
H -0.233681 -0.109435 1.673729
H 1.464219 -2.505871 1.283793
H -1.775129 1.218123 0.029663
H -3.072938 -2.457361 1.970799
H 3.408576 -0.255811 1.779264
H 5.066968 -0.640233 -2.201239
H -5.452251 -1.924635 1.317922
H 4.257973 -3.674072 -1.386181
H 4.035658 2.164502 1.825042
H 5.685020 1.815357 -2.177352
H -5.108422 3.832222 -0.737280
H -5.952481 2.559804 0.241434
H -4.455056 3.351319 0.877340
H 5.026084 3.950896 0.606223
H -7.652156 0.476132 -1.529997
H -6.401071 -0.770878 -1.910860
H -5.964714 0.984119 -1.957852


