%chk=000154368.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154368

0 1
 O  -0.3349000     -3.8899999E-02  0.6264000    
 O   -4.930700     -0.5426000     -0.2885000    
 N   -3.663400     -0.2806000     -0.9411000    
 C   -2.699200     -0.1115000      0.1447000    
 C   -1.282200     -0.1577000     -0.4280000    
 C   0.9875000     -2.1500001E-02  0.2688000    
 C    1.697400      -1.216000      0.1860000    
 C    1.612700       1.190700     -8.8000000E-03
 C   -2.969300       1.197300      0.8876000    
 C    3.044000      -1.198000     -0.1772000    
 C    2.959300       1.208600     -0.3720000    
 C    3.674900      1.4200000E-02 -0.4563000    
 C    1.039900      -2.523700      0.4815000    
 C   0.8641000       2.479900      7.7100001E-02
 H   -2.796800     -0.9340000      0.8662000    
 H   -1.124100      -1.107800     -0.9534000    
 H   -1.138500      0.6543000      -1.152100    
 H   -3.975400       1.217700       1.320200    
 H   -2.870900       2.061300      0.2206000    
 H   -2.263200       1.332200       1.713900    
 H   -3.504000      -1.169800      -1.413300    
 H    3.614100      -2.120500     -0.2492000    
 H    3.464300       2.144900     -0.5944000    
 H   0.3640000      -2.443900       1.339400    
 H   0.4752000      -2.869800     -0.3895000    
 H    1.778300      -3.292500      0.7351000    
 H   0.2536000       2.625700     -0.8192000    
 H   0.2174000       2.503300      0.9605000    
 H    1.545900       3.333000      0.1648000    
 H    4.723100      2.8100001E-02 -0.7402000    
 H   -5.487500      0.1041000     -0.7541000    


%chk=000154368-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154368

0 1
O -0.332200 -0.030189 0.643409
O -5.023469 -0.626952 -0.339892
N -3.669717 -0.357629 -0.941390
C -2.707298 -0.113340 0.183255
C -1.310067 -0.052366 -0.463682
C 1.033524 -0.019986 0.227066
C 1.727966 -1.259549 0.178254
C 1.668515 1.221829 -0.045281
C -3.060350 1.187424 0.917239
C 3.100675 -1.236412 -0.170814
C 3.043067 1.198937 -0.391274
C 3.754550 -0.018348 -0.461339
C 1.017866 -2.559606 0.507296
C 0.905184 2.530462 0.047604
H -2.710352 -0.955422 0.910322
H -1.124992 -0.943588 -1.102833
H -1.209377 0.856743 -1.089079
H -4.033859 1.089151 1.426160
H -3.115188 2.029795 0.202550
H -2.288276 1.407491 1.673700
H -3.446556 -1.269528 -1.385430
H 3.657154 -2.180565 -0.207896
H 3.555188 2.146438 -0.598149
H 0.355311 -2.436643 1.381028
H 0.382051 -2.900534 -0.333414
H 1.744312 -3.362791 0.718793
H 0.413530 2.783938 -0.912302
H 0.115880 2.472923 0.816077
H 1.583881 3.364475 0.296573
H 4.817623 -0.017084 -0.726614
H -5.568977 0.117427 -0.704437


