%chk=000149446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149446

0 1
 O   -4.693800      -3.594600      0.2629000    
 O    4.867700      -3.069700     -0.1116000    
 O    4.623500      -1.789300       1.654800    
 N   -2.424500      -1.929200     -0.1590000    
 N  -0.3428000       1.177900      0.1162000    
 N    1.233600       2.516600     -0.6620000    
 N    2.662800     -0.2977000      0.3500000    
 N    1.843800     -0.5257000      -1.701600    
 N    4.304500      -2.097800      0.4702000    
 C   -1.791100     -0.6924000     -0.6117000    
 C   -1.013500     -5.0099999E-02  0.5335000    
 C   -3.386700      -1.658800      0.9181000    
 C   -3.096100      -2.610100      -1.274900    
 C   -4.042700      -2.962100       1.365300    
 C   -3.760000      -3.890500     -0.7763000    
 C  -0.8846000       2.427800      0.1741000    
 C   0.9165000       1.271600     -0.3859000    
 C   0.1226000       3.252500     -0.3193000    
 C    1.784700      0.1702000     -0.5879000    
 C   -2.125500       2.903300      0.5991000    
 C  -0.1044000       4.636800     -0.4007000    
 C   -2.334200       4.283700      0.5112000    
 C    3.323500      -1.359400     -0.2007000    
 C   -1.343000       5.136800      2.0500001E-02
 C    2.858800      0.2315000       1.682400    
 C    2.800600      -1.481100      -1.466700    
 H   -2.532600      1.2500000E-02  -1.010900    
 H   -1.096400     -0.9155000      -1.431300    
 H  -0.2546000     -0.7327000      0.9327000    
 H   -1.644600      0.2433000       1.376600    
 H   -4.158400     -0.9567000      0.5771000    
 H   -2.910000      -1.243500       1.809400    
 H   -2.371400      -2.867000      -2.055900    
 H   -3.856400      -1.954100      -1.718400    
 H   -3.313300      -3.653300       1.805300    
 H   -4.803000      -2.755600       2.125500    
 H   -4.311400      -4.366800      -1.593200    
 H   -3.020900      -4.613200     -0.4095000    
 H   -2.899400       2.245100      0.9772000    
 H   0.6593000       5.307900     -0.7805000    
 H   -3.286900       4.699500      0.8301000    
 H   -1.534900       6.205300     -3.5999998E-02
 H    2.608600     -0.5426000       2.412100    
 H    3.891700      0.5750000       1.780100    
 H    2.200500       1.086100       1.854000    
 H    3.059800      -2.205600      -2.225700    


%chk=000149446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149446

0 1
O -5.150296 -3.631868 -0.445909
O 5.201201 -3.064745 -0.180520
O 5.961059 -0.905796 -0.027599
N -2.839788 -1.900235 -0.165304
N -0.453639 0.944764 0.623357
N 1.309510 2.358487 0.187466
N 3.215233 -0.018389 0.161617
N 1.374800 -1.381746 0.149143
N 5.006030 -1.787765 -0.061327
C -1.870484 -0.825892 -0.460566
C -1.276605 -0.261359 0.854313
C -4.211185 -1.403407 0.111917
C -2.870883 -2.980051 -1.185539
C -5.108956 -2.566337 0.568050
C -3.784020 -4.120032 -0.705731
C -0.968756 2.249115 0.621142
C 0.927147 1.063577 0.344685
C 0.145236 3.116905 0.355934
C 1.820740 -0.079550 0.226252
C -2.273529 2.746818 0.833546
C -0.038602 4.519653 0.297484
C -2.436406 4.145080 0.773509
C 3.644973 -1.353086 0.040524
C -1.336550 5.019294 0.509476
C 4.070661 1.192902 0.222790
C 2.497012 -2.165116 0.036836
H -2.323748 0.002474 -1.058225
H -1.035344 -1.246426 -1.047511
H -0.658480 -1.042263 1.317482
H -2.081114 0.017178 1.558208
H -4.660462 -0.926940 -0.796076
H -4.175388 -0.639852 0.912655
H -1.844361 -3.365538 -1.328249
H -3.244133 -2.607220 -2.171911
H -4.725550 -2.975154 1.527819
H -6.154040 -2.238013 0.693559
H -3.891524 -4.898524 -1.478798
H -3.364474 -4.566129 0.221547
H -3.126023 2.089195 1.030878
H 0.808492 5.181198 0.094155
H -3.431746 4.575005 0.929975
H -1.514167 6.099229 0.471520
H 4.732209 1.136471 1.101065
H 4.701403 1.245751 -0.677522
H 3.402227 2.064191 0.274853
H 2.457720 -3.247551 -0.042271


