%chk=000132235.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132235

0 1
 O    2.521200     -0.3723000      -1.619200    
 O   -1.598400       1.198200      -1.460700    
 N    1.071800     -0.1530000      0.1660000    
 N   -1.291800     -0.4709000      0.1086000    
 C  -1.0500000E-02 -0.9615000     -0.3834000    
 C   0.2029000      -2.464100     -6.5200001E-02
 C    3.260900      0.9618000      0.2769000    
 C   -3.324700      0.9063000      0.2279000    
 C    2.264400      7.9599999E-02 -0.5031000    
 C   -1.989900      0.5774000     -0.4724000    
 C  -0.8855000      -3.339300     -0.6924000    
 C   0.2972000      -2.746800       1.438300    
 C    3.622000      0.2913000       1.611300    
 C    2.652200       2.349500      0.5292000    
 C    4.547600       1.133000     -0.5505000    
 C   -3.066300       1.298000       1.691000    
 C   -4.040200       2.049100     -0.5082000    
 C   -4.232800     -0.3364000      0.2059000    
 H  -3.9999999E-04 -0.8293000      -1.472500    
 H    1.161800      -2.765600     -0.5084000    
 H   0.9225000      0.2434000       1.087700    
 H   -1.648600     -0.8828000      0.9632000    
 H  -0.6595000      -4.400800     -0.5449000    
 H  -0.9533000      -3.159900      -1.770500    
 H   -1.868600      -3.143100     -0.2516000    
 H   0.5124000      -3.807000       1.612500    
 H  -0.6358000      -2.512400       1.960000    
 H    1.103800      -2.172700       1.905000    
 H    2.762200      0.2295000       2.286900    
 H    4.406900      0.8491000       2.134400    
 H    3.983700     -0.7310000       1.451200    
 H    3.377500       3.019600       1.004200    
 H    2.329100       2.812500     -0.4104000    
 H    1.775600       2.299900       1.184200    
 H    4.338800       1.608700      -1.515900    
 H    5.018700      0.1650000     -0.7570000    
 H    5.280300       1.755000     -2.4200000E-02
 H   -3.991800       1.620600       2.181300    
 H   -2.349700       2.125400       1.750500    
 H   -2.657200      0.4713000       2.281200    
 H   -4.242300       1.785000      -1.552700    
 H   -3.429100       2.959000     -0.5118000    
 H   -4.997000       2.292400     -3.3000000E-02
 H   -4.370600     -0.7014000     -0.8186000    
 H   -5.222900     -0.1092000      0.6176000    
 H   -3.819800      -1.164700      0.7917000    


%chk=000132235-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000132235

0 1
O 2.495452 -0.253693 -1.574324
O -1.507193 1.624413 -0.665814
N 1.080437 -0.178243 0.249805
N -1.300618 -0.518566 0.194334
C -0.041335 -0.799592 -0.501078
C 0.172997 -2.327046 -0.710418
C 3.319795 0.958202 0.409923
C -3.362693 0.822274 0.741476
C 2.270982 0.128117 -0.379830
C -1.987168 0.679913 0.031015
C -0.859618 -2.892528 -1.711682
C 0.186211 -3.125657 0.614364
C 2.896758 1.284521 1.864069
C 3.528146 2.280400 -0.384808
C 4.644249 0.144348 0.415546
C -3.243414 2.021842 1.725657
C -4.405106 1.165204 -0.361363
C -3.815501 -0.443948 1.510498
H -0.065296 -0.306923 -1.491862
H 1.176057 -2.399010 -1.170863
H 0.872583 0.194512 1.176517
H -1.724426 -1.270011 0.738631
H -0.643591 -3.953580 -1.932335
H -0.833433 -2.336338 -2.666490
H -1.891211 -2.835940 -1.313750
H 0.507511 -4.165944 0.427031
H -0.817159 -3.186789 1.083298
H 0.887088 -2.682485 1.344846
H 1.982570 1.908887 1.900302
H 3.698813 1.861581 2.359061
H 2.735823 0.368275 2.465047
H 4.326060 2.883650 0.087115
H 3.818353 2.055047 -1.424854
H 2.602159 2.883977 -0.409094
H 4.925517 -0.124970 -0.616410
H 4.540237 -0.788637 1.000818
H 5.457941 0.744315 0.863604
H -4.228061 2.240296 2.178809
H -2.892433 2.918877 1.188022
H -2.529687 1.805028 2.542861
H -4.530265 0.325714 -1.070414
H -4.077303 2.050669 -0.931108
H -5.387444 1.378363 0.099290
H -3.940871 -1.315129 0.838426
H -4.798371 -0.255489 1.978861
H -3.116742 -0.711507 2.327369


