%chk=000177236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177236

0 1
 O   -2.210100      0.8590000      -1.770700    
 O   0.5278000      0.2205000      0.5875000    
 O   4.7499999E-02   2.824000      -1.749200    
 O  -8.1100002E-02   2.933900      0.5122000    
 O    4.384500      -2.073900       1.742600    
 O    4.549200       1.585900      -1.266200    
 N    2.441800     -0.9402000       1.179100    
 N    2.525700      0.9203000     -0.3503000    
 C   -1.631000      0.2316000     -0.6063000    
 C  -0.1585000      0.7466000     -0.5385000    
 C   -2.405500      0.6734000      0.6491000    
 C   -1.799300      -1.274500     -0.8788000    
 C   -3.380400       1.627600      0.5082000    
 C  -0.6763000      -2.061500     -0.8924000    
 C   -2.083100      9.2100002E-02   1.848600    
 C   -3.064500      -1.757500      -1.095500    
 C  -7.1199998E-02   2.269600     -0.5173000    
 C   -1.519600      0.4723000      -2.941300    
 C   -4.081600       2.027900       1.645700    
 C  -0.8290000      -3.425800      -1.139600    
 C   -2.784500      0.4924000       2.986000    
 C   -3.217200      -3.121900      -1.342600    
 C   -3.783600       1.460300       2.884500    
 C   -2.099600      -3.955900      -1.364700    
 C    1.884400      6.0600001E-02  0.4673000    
 C    3.777400      -1.068900       1.037400    
 C    3.858700      0.7345000     -0.4450000    
 C    4.545100     -0.2530000      0.2316000    
 C    3.544100      -2.883500       2.556700    
 C    3.790000       2.584200      -1.938200    
 H   0.3926000      0.4408000      -1.437200    
 H   -3.636300       2.095600     -0.4356000    
 H   0.3356000      -1.715800     -0.7620000    
 H   -1.328300     -0.6798000       1.949200    
 H   -3.942800      -1.120300      -1.084400    
 H  -0.8291000     -0.3727000      -2.901900    
 H  -0.9891000       1.333800      -3.354600    
 H   -2.279900      0.2150000      -3.687900    
 H   -4.859000       2.782500       1.567500    
 H   4.1499998E-02  -4.074900      -1.164900    
 H   -2.556500      4.6500001E-02   3.949800    
 H   -4.206200      -3.534500      -1.519100    
 H   -4.330300       1.771200       3.769900    
 H   -2.218100      -5.017800      -1.559200    
 H   0.1156000       3.801500      -1.705900    
 H    5.616100     -0.3795000      0.1364000    
 H    4.171900      -3.632300       3.048500    
 H    2.800800      -3.411900       1.950200    
 H    3.058300      -2.286100       3.335600    
 H    3.051000       2.130900      -2.607500    
 H    4.478000       3.177500      -2.547600    
 H    3.306000       3.257600      -1.222700    


%chk=000177236-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177236

0 1
O -2.326598 1.082280 -1.701351
O 0.530960 -0.111509 0.376484
O 0.121515 2.843591 -1.674047
O 0.154846 2.730260 0.645527
O 4.452444 -1.401129 2.546637
O 4.674880 1.346485 -1.352261
N 2.456837 -0.763150 1.456735
N 2.574152 0.635377 -0.526537
C -1.631859 0.217406 -0.711828
C -0.117484 0.654304 -0.699039
C -2.311736 0.524870 0.637696
C -1.803534 -1.263905 -1.107058
C -3.160233 1.648342 0.782913
C -0.748564 -2.102160 -1.541204
C -2.085786 -0.321136 1.752308
C -3.126024 -1.782730 -1.104627
C 0.061629 2.155679 -0.452995
C -2.000770 0.870267 -3.119251
C -3.779248 1.918617 2.024305
C -1.006347 -3.429290 -1.956817
C -2.698993 -0.045283 2.992318
C -3.386745 -3.102424 -1.524466
C -3.550049 1.075327 3.134381
C -2.324522 -3.934804 -1.952219
C 1.916433 -0.067014 0.430406
C 3.818548 -0.726541 1.527805
C 3.936390 0.647799 -0.422033
C 4.630266 -0.024839 0.604414
C 3.590953 -2.112660 3.520449
C 3.929331 2.042267 -2.425093
H 0.361744 0.419630 -1.665200
H -3.341642 2.292485 -0.081050
H 0.285670 -1.745251 -1.542700
H -1.423029 -1.185271 1.650204
H -3.946396 -1.136405 -0.774210
H -2.163767 -0.181283 -3.421657
H -0.965136 1.180598 -3.352846
H -2.701233 1.522676 -3.664195
H -4.437389 2.789533 2.123043
H -0.175485 -4.066339 -2.280255
H -2.511523 -0.704541 3.847392
H -4.413995 -3.483627 -1.515500
H -4.027770 1.287494 4.097870
H -2.522901 -4.963388 -2.273745
H 0.160589 3.820871 -1.487389
H 5.715605 -0.003817 0.684480
H 4.300849 -2.541240 4.242211
H 3.007729 -2.900618 3.015787
H 2.897013 -1.408397 4.007881
H 3.411647 1.312487 -3.070650
H 4.705636 2.582612 -2.985419
H 3.184993 2.734893 -1.999105


