%chk=000146372.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146372

0 1
 O   0.2472000       1.757900     -0.8744000    
 N  -0.1875000      -1.153100     -0.2657000    
 N   0.9120000      -3.153500     -0.1024000    
 N  -0.7969000      -2.698300       1.460400    
 C   0.9848000     -0.9407000      -1.103500    
 C    1.462100      -2.396700      -1.261000    
 C    1.878200      3.8800001E-02 -0.3847000    
 C   -1.181700     -0.1673000     -0.1746000    
 C  -4.8500001E-02  -2.376500      0.3642000    
 C    1.411100       1.355900     -0.2631000    
 C  -0.9468000       1.199300     -0.4540000    
 C    3.100600     -0.2873000      0.2140000    
 C   -2.506700     -0.5189000      0.1610000    
 C   -3.534600      0.4257000      0.2432000    
 C   -1.987700       2.142900     -0.3867000    
 C    2.160600       2.335800      0.3910000    
 C    3.845300      0.6862000      0.8869000    
 C   -3.273800       1.759800     -2.7500000E-02
 C    3.378200       1.996000      0.9725000    
 C   -4.916200     -6.0000001E-03  0.6041000    
 H   0.7366000     -0.5542000      -2.101200    
 H    1.033900      -2.836600      -2.170800    
 H    2.547000      -2.509400      -1.327300    
 H    3.496800      -1.297100      0.1818000    
 H   -2.770200      -1.562300      0.3221000    
 H   -1.792300       3.188200     -0.6161000    
 H    1.800700       3.359000      0.4506000    
 H    4.793300      0.4190000       1.345500    
 H   -4.061200       2.506300      2.1400001E-02
 H   -1.381000      -2.021300       1.936900    
 H  -0.6703000      -3.590500       1.926300    
 H    3.963800       2.749600       1.490200    
 H   -4.893300     -0.8196000       1.337300    
 H   -5.485300      0.8144000       1.054400    
 H   -5.447700     -0.3502000     -0.2886000    


%chk=000146372-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146372

0 1
O 0.253803 1.813210 -0.711808
N -0.226601 -1.109748 -0.224174
N 0.911675 -3.119004 -0.002882
N -0.885793 -2.687484 1.511195
C 0.999981 -0.923375 -1.070202
C 1.466660 -2.406562 -1.197107
C 1.952560 0.042217 -0.367028
C -1.253665 -0.146456 -0.121412
C -0.066132 -2.351713 0.449339
C 1.500548 1.373848 -0.182941
C -1.002673 1.243024 -0.350189
C 3.231088 -0.294805 0.131867
C -2.597540 -0.538035 0.149770
C -3.659315 0.391822 0.222212
C -2.060508 2.171730 -0.306442
C 2.304925 2.359396 0.421238
C 4.046041 0.675287 0.761079
C -3.376083 1.761105 -0.011981
C 3.588142 2.005619 0.894815
C -5.080865 -0.078476 0.483397
H 0.702875 -0.498847 -2.046181
H 1.061199 -2.856093 -2.125824
H 2.562842 -2.510297 -1.234120
H 3.598917 -1.320571 0.033632
H -2.812702 -1.606144 0.260752
H -1.819739 3.222935 -0.491673
H 1.916822 3.378096 0.513411
H 5.033483 0.393029 1.141256
H -4.180363 2.503609 0.032272
H -1.388392 -1.968090 2.025926
H -0.692508 -3.577708 1.963819
H 4.220039 2.762695 1.371611
H -5.106889 -0.945853 1.166631
H -5.693928 0.724481 0.928871
H -5.577403 -0.387543 -0.456931


