%chk=000145660.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145660

0 1
 O    3.972300     -0.2883000      0.4012000    
 N   6.4800002E-02  7.4500002E-02 -0.5926000    
 N   -4.737900      0.4077000      0.5211000    
 C   -1.276800      0.2036000      -1.168500    
 C   -2.336000      0.2452000     -6.7599997E-02
 C   0.7838000       1.250100     -0.2783000    
 C   0.5677000      -1.220200     -0.3300000    
 C   -3.779600      0.3235000     -0.5743000    
 C    2.137400       1.155100      9.9699996E-02
 C    1.915800      -1.377400      4.6700001E-02
 C    2.770900     -0.1788000      0.1919000    
 C   0.2210000       2.539400     -0.3030000    
 C  -0.2104000      -2.390000     -0.4059000    
 C    2.901700       2.291000      0.4029000    
 C    2.469800      -2.640400      0.2999000    
 C   0.9784000       3.675500      3.1000001E-03
 C   0.3366000      -3.652100     -0.1498000    
 C    2.318300       3.551900      0.3499000    
 C    1.676400      -3.777600      0.1969000    
 C   -4.680200     -0.7974000       1.350600    
 C   -6.094100      0.6046000      6.0999999E-03
 H   -1.358300       1.090200      -1.809600    
 H   -1.488000     -0.6157000      -1.867600    
 H   -2.148000       1.100800      0.5935000    
 H   -2.205900     -0.6427000      0.5581000    
 H   -3.989300     -0.5382000      -1.221700    
 H   -3.863900       1.220600      -1.201200    
 H  -0.8213000       2.707200     -0.5573000    
 H   -1.263700      -2.365100     -0.6695000    
 H    3.946600       2.209700      0.6893000    
 H    3.512100      -2.753800      0.5857000    
 H   0.5153000       4.657800     -2.9700000E-02
 H  -0.2896000      -4.536900     -0.2231000    
 H    2.904200       4.434800      0.5868000    
 H    2.099300      -4.757900      0.3947000    
 H   -4.777300      -1.716500      0.7613000    
 H   -5.489900     -0.7895000       2.090600    
 H   -3.759500     -0.8435000       1.939700    
 H   -6.423500     -0.2320000     -0.6207000    
 H   -6.151400       1.524300     -0.5871000    
 H   -6.806600      0.7208000      0.8303000    


%chk=000145660-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145660

0 1
O 4.132679 -0.271012 0.540432
N 0.084454 0.048875 -0.516980
N -4.858547 0.428216 0.472196
C -1.303223 0.163776 -1.028655
C -2.377385 0.180953 0.083699
C 0.819430 1.219246 -0.221795
C 0.655135 -1.230368 -0.333482
C -3.796241 0.156490 -0.522090
C 2.204238 1.132092 0.140820
C 2.036207 -1.362147 0.030308
C 2.890064 -0.174129 0.252879
C 0.212260 2.511806 -0.275811
C -0.117475 -2.421068 -0.503082
C 2.941256 2.316740 0.407398
C 2.606501 -2.653344 0.187550
C 0.964521 3.666493 -0.006126
C 0.472128 -3.685284 -0.340590
C 2.341145 3.580795 0.332272
C 1.844279 -3.814604 0.001504
C -4.950293 -0.602724 1.526934
C -6.165739 0.664117 -0.176565
H -1.373149 1.077627 -1.643100
H -1.486652 -0.674906 -1.722769
H -2.271756 1.088475 0.706368
H -2.217886 -0.688450 0.747840
H -3.956849 -0.827881 -1.043341
H -3.867260 0.942064 -1.301423
H -0.850012 2.625536 -0.503462
H -1.182297 -2.372162 -0.742501
H 3.995744 2.188864 0.674031
H 3.666422 -2.690876 0.460719
H 0.471549 4.644228 -0.050751
H -0.145264 -4.580900 -0.473986
H 2.917810 4.487627 0.539605
H 2.293403 -4.805016 0.125062
H -5.175280 -1.624247 1.124152
H -5.753440 -0.330014 2.233899
H -4.008430 -0.657444 2.097956
H -6.557492 -0.228515 -0.728715
H -6.080746 1.499452 -0.894557
H -6.912609 0.945917 0.586661


