%chk=000157073.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157073

0 1
 O   0.5592000      -2.510200      -1.375800    
 O   0.6127000      0.3089000      -2.404300    
 O    1.272600      -2.276000       1.528200    
 N   -3.074500      -1.428400      0.3963000    
 C   0.4420000      -1.349000     -0.5932000    
 C  -0.9571000      -1.103700     -0.1973000    
 C   -1.571900      0.1687000     -1.4200000E-02
 C   -1.909200      -2.065200      6.3000001E-02
 C    1.000600     -0.1448000      -1.343900    
 C    1.333200      -1.448200      0.6383000    
 C   -2.897900     -6.3600004E-02  0.3573000    
 C    2.132500      0.3855000     -0.5794000    
 C    2.325200     -0.3715000      0.5732000    
 C   -1.123300       1.499300     -0.1300000    
 C   -1.831600      -3.538300      2.8200001E-02
 C   -3.801300      0.9723000      0.6199000    
 C   -2.015600       2.545800      0.1297000    
 C    2.937400       1.466800     -0.8807000    
 C    3.331500     -7.9599999E-02   1.473200    
 C   -3.333700       2.284100      0.4987000    
 C    3.960800       1.777100      1.8900000E-02
 C    4.156000       1.011400       1.184700    
 C   -1.547700       3.958200      9.2000002E-03
 H   -3.941900      -1.888900      0.6362000    
 H  -0.1082000       1.770300     -0.3824000    
 H   -1.821100      -3.897900      -1.005600    
 H  -0.9273000      -3.897100      0.5295000    
 H   -2.687600      -3.999300      0.5326000    
 H    1.495800      -2.629000      -1.609500    
 H   -4.827600      0.7694000      0.9068000    
 H    2.788700       2.058900      -1.776400    
 H    3.484200     -0.6667000       2.371600    
 H   -4.022300       3.102400      0.6972000    
 H    4.615900       2.620900     -0.1816000    
 H    4.959300       1.274300       1.868100    
 H  -0.5526000       4.076000      0.4517000    
 H   -2.215800       4.651000      0.5320000    
 H   -1.504600       4.250800      -1.044700    


%chk=000157073-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157073

0 1
O 0.218615 -2.411808 -1.947219
O 1.035741 0.332329 -2.714356
O 1.533023 -2.925726 0.737180
N -2.832876 -1.359448 0.785345
C 0.457020 -1.369404 -0.957149
C -0.865822 -1.024006 -0.300995
C -1.508452 0.273001 -0.113807
C -1.709740 -2.003486 0.264404
C 1.184649 -0.118084 -1.552275
C 1.447266 -1.792911 0.196670
C -2.742031 0.023493 0.583398
C 2.147810 0.370214 -0.523700
C 2.287714 -0.599502 0.505494
C -1.201963 1.619381 -0.460454
C -1.597173 -3.500045 0.315287
C -3.635428 1.051006 0.946182
C -2.081198 2.665776 -0.107420
C 2.891793 1.567521 -0.501702
C 3.169423 -0.389972 1.585409
C -3.289145 2.369975 0.597771
C 3.770430 1.784323 0.583522
C 3.907176 0.815214 1.616843
C -1.761480 4.105507 -0.478034
H -3.611180 -1.841633 1.231171
H -0.299459 1.864182 -1.027116
H -1.820851 -3.939126 -0.673595
H -0.570071 -3.805046 0.573689
H -2.295172 -3.927805 1.058348
H 1.055676 -2.599530 -2.445780
H -4.570010 0.836110 1.476516
H 2.786445 2.300045 -1.308407
H 3.276281 -1.148832 2.366898
H -3.964359 3.192283 0.863959
H 4.359919 2.706342 0.632212
H 4.600925 1.007537 2.442658
H -0.822470 4.174549 -1.054019
H -1.651288 4.740043 0.422346
H -2.564938 4.552236 -1.093775


