%chk=000149676.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149676

0 1
 O    6.465000     -0.7373000      0.4950000    
 O    5.959900       1.970400      0.4914000    
 N    3.043500      3.5300002E-02 -0.6798000    
 C    4.457200      0.2993000     -0.4634000    
 C   -1.775700     -0.8794000      8.1500001E-02
 C   -1.353200      0.4383000      0.1884000    
 C   -3.152900     -0.9329000     -8.2000002E-02
 C   0.8852000     -0.3838000      0.4142000    
 C    2.345000     -0.1210000      0.5960000    
 C   -2.529000       1.291900      8.8100001E-02
 C  -0.9366000      -1.990500      0.1312000    
 C   -3.654400      0.4345000     -8.0899999E-02
 C  -6.6999998E-03  0.7020000      0.3573000    
 C   0.4343000      -1.717100      0.3034000    
 C    5.064300     -0.8947000      0.3007000    
 C    4.592100       1.625400      0.3097000    
 C    5.123300      0.4529000      -1.839200    
 C   -3.768700      -2.164200     -0.2076000    
 C   -1.568400      -3.242900      2.6000000E-03
 C   -2.676500       2.665000      0.1303000    
 C   -4.931100      0.9474000     -0.2084000    
 C   -2.968100      -3.319600     -0.1644000    
 C   -3.968000       3.184200      1.5000000E-03
 C   -5.080500       2.336700     -0.1656000    
 H    2.408300      0.7678000       1.229600    
 H    2.722200     -0.9552000       1.194000    
 H    2.930200     -0.8147000      -1.232700    
 H   0.3522000       1.723200      0.4413000    
 H    1.144600      -2.539800      0.3477000    
 H    4.914000      -1.833300     -0.2448000    
 H    4.662500      -1.022600       1.308200    
 H    4.102400       2.449200     -0.2228000    
 H    4.184100       1.574300       1.321500    
 H    5.015300     -0.4600000      -2.437400    
 H    6.196000      0.6582000      -1.753600    
 H    4.676400       1.275800      -2.410100    
 H   -4.842400      -2.250800     -0.3370000    
 H  -0.9840000      -4.159100      3.0999999E-02
 H   -1.827400       3.327200      0.2584000    
 H   -5.794700      0.3047000     -0.3376000    
 H   -3.437400      -4.295800     -0.2619000    
 H   -4.118600       4.260500      3.0500000E-02
 H   -6.071700       2.772600     -0.2629000    
 H    6.600500      4.5600001E-02   1.054700    
 H    5.981600       2.818400      0.9668000    


%chk=000149676-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149676

0 1
O 6.803254 -0.218342 0.021202
O 5.777318 2.077165 0.970490
N 3.010759 0.048320 -0.511960
C 4.414874 0.529931 -0.377808
C -1.865584 -1.068699 0.164748
C -1.232091 0.212253 0.060266
C -3.287755 -0.961998 0.043191
C 0.909054 -0.937835 0.362888
C 2.427313 -0.849736 0.509305
C -2.324285 1.196740 -0.141652
C -1.164946 -2.284105 0.358750
C -3.579229 0.480249 -0.151271
C 0.158866 0.278000 0.158863
C 0.267138 -2.186124 0.453615
C 5.395952 -0.605325 0.073534
C 4.382928 1.674036 0.670727
C 4.852237 1.090620 -1.748235
C -4.048790 -2.133895 0.122902
C -1.968687 -3.473957 0.434740
C -2.302680 2.593489 -0.310348
C -4.791372 1.172653 -0.328220
C -3.366923 -3.384440 0.319698
C -3.529259 3.283154 -0.488181
C -4.759517 2.580657 -0.496711
H 2.669657 -0.433153 1.507871
H 2.848430 -1.881359 0.496839
H 2.800827 -0.264667 -1.467137
H 0.719835 1.213959 0.068636
H 0.866054 -3.094623 0.597459
H 5.293112 -1.463734 -0.615940
H 5.122138 -0.945543 1.098283
H 3.812775 2.526565 0.253287
H 3.889392 1.326074 1.601490
H 4.940085 0.276593 -2.491954
H 5.836460 1.578007 -1.670596
H 4.111465 1.827379 -2.110101
H -5.141240 -2.123859 0.039734
H -1.492209 -4.450197 0.583454
H -1.356680 3.146183 -0.306805
H -5.748772 0.640019 -0.337748
H -3.965323 -4.300676 0.381562
H -3.526791 4.370763 -0.621005
H -5.695952 3.132316 -0.635716
H 6.858380 0.665949 0.484839
H 5.793884 2.787291 1.655913


