%chk=000123965.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123965

0 1
 O    1.316100       1.820400      -1.724100    
 O   -1.249000      -1.723200     -0.4618000    
 O    2.899400     -0.6829000      -1.479000    
 O    2.387500       4.281400     -0.6189000    
 N   -3.439200     -6.8000004E-02  0.1877000    
 C  -0.5904000      0.5778000     -0.8479000    
 C  -0.9140000     -0.5004000      0.2063000    
 C   -2.173300      0.2014000      0.8834000    
 C   0.7345000      0.4791000      -1.646100    
 C   -1.874900      0.7563000      -1.773800    
 C  -0.2194000       1.811300     -2.0700000E-02
 C   0.2932000     -0.8918000       1.120700    
 C   -1.729100       1.228800       1.967800    
 C   -3.194600     -3.1099999E-02  -1.295000    
 C  -0.6956000       2.154400       1.271200    
 C   -4.141900      -1.248600      0.6479000    
 C    1.695500     -0.4037000     -0.9263000    
 C    1.534500      -1.032800      0.2917000    
 C   -5.522500      -1.345100      2.1000000E-02
 C   0.8294000       2.475000     -0.6180000    
 C   -6.384700      -2.488800      0.4064000    
 C   -5.768200      -2.429900     -0.9605000    
 C  -0.1566000       3.290000       1.869200    
 C    2.736800      -1.751800      0.5178000    
 C    1.361900       3.607900     -3.9799999E-02
 C    3.539800      -1.505300     -0.5963000    
 C   0.8502000       4.020200       1.203000    
 C    3.239500      -2.582000       1.535500    
 C    4.818100      -2.034400     -0.7674000    
 C    4.522100      -3.127300       1.388800    
 C    5.295000      -2.857100      0.2571000    
 H   -2.313100     -0.5707000       1.661400    
 H   0.5845000      0.1055000      -2.664500    
 H   -1.655300      0.4130000      -2.791500    
 H   -2.126100       1.822400      -1.839700    
 H   8.8299997E-02  -1.841200       1.630600    
 H   0.5065000     -0.1559000       1.899900    
 H   -1.278100      0.7657000       2.852600    
 H   -2.590200       1.829300       2.280600    
 H   -4.058100      0.4426000      -1.777000    
 H   -3.138000      -1.047100      -1.705100    
 H   -3.579200      -2.172900      0.4792000    
 H   -4.314900      -1.171700       1.729800    
 H   -6.016500     -0.3895000     -0.1045000    
 H   -1.473600      -2.383400      0.2150000    
 H   -7.451400      -2.317600      0.4844000    
 H   -5.999300      -3.225300       1.100600    
 H   -4.976000      -3.133100      -1.185300    
 H   -6.419600      -2.213800      -1.798700    
 H  -0.4911000       3.609900       2.851700    
 H    1.259600       4.901700       1.692600    
 H    2.651400      -2.801800       2.421400    
 H    5.412900      -1.820500      -1.647500    
 H    2.627200       5.035800     -5.3700000E-02
 H    4.920800      -3.770700       2.169100    
 H    6.286600      -3.294300      0.1710000    


%chk=000123965-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123965

0 1
O 1.145576 1.689099 -1.750024
O -0.800003 -2.311345 -0.569747
O 3.250642 -0.612405 -1.491526
O 1.553579 4.434831 -0.802228
N -3.106340 -0.489868 0.167176
C -0.476887 0.084502 -0.827834
C -0.625368 -1.061799 0.202986
C -1.919111 -0.733825 1.034560
C 0.863607 0.175520 -1.635986
C -1.706468 0.109688 -1.807474
C -0.388309 1.371931 -0.008004
C 0.625874 -1.218723 1.119927
C -1.731178 0.519612 1.948556
C -2.940868 -0.659604 -1.291234
C -1.014220 1.649170 1.217577
C -4.355198 -1.052426 0.720092
C 1.959200 -0.514116 -0.910705
C 1.891536 -1.161699 0.306057
C -5.614142 -0.383580 0.179353
C 0.494997 2.261381 -0.638315
C -6.976243 -1.053067 0.414715
C -6.391358 -0.984227 -1.004149
C -0.818203 2.950337 1.747092
C 3.213122 -1.708833 0.562652
C 0.686718 3.560559 -0.126133
C 4.016700 -1.347210 -0.562268
C -0.005219 3.892569 1.070532
C 3.805267 -2.459398 1.609739
C 5.368382 -1.689317 -0.699480
C 5.165037 -2.817233 1.493339
C 5.936161 -2.438829 0.356372
H -2.097279 -1.619698 1.692791
H 0.782457 -0.151793 -2.683601
H -1.410463 -0.340209 -2.772480
H -1.968038 1.165848 -1.998026
H 0.552135 -2.180443 1.668703
H 0.645949 -0.424632 1.887725
H -1.160137 0.253180 2.863724
H -2.733942 0.838604 2.288909
H -3.845767 -0.252921 -1.775904
H -2.855350 -1.731930 -1.577918
H -4.429492 -2.159636 0.542918
H -4.328389 -0.910138 1.819313
H -5.584044 0.710763 0.238933
H -0.804306 -3.075097 0.061794
H -7.833282 -0.418237 0.656450
H -6.985548 -2.028150 0.913924
H -6.010912 -1.912932 -1.442837
H -6.854696 -0.302633 -1.723624
H -1.284461 3.232774 2.697970
H 0.127524 4.895610 1.498472
H 3.226696 -2.752159 2.492844
H 5.947990 -1.389065 -1.576669
H 1.621055 5.295242 -0.318231
H 5.642571 -3.395463 2.291941
H 6.989845 -2.732380 0.299564


