%chk=000070805.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070805

0 1
 O    1.205300       1.745100      0.3948000    
 O    3.471000     -8.3200000E-02   1.106000    
 N  -0.1894000     -7.3399998E-02  2.4100000E-02
 C   -1.347400      0.4499000      0.7141000    
 C   -2.215600       1.291600     -0.2271000    
 C   -2.160100     -0.6774000       1.360000    
 C   -2.959700      0.4393000      -1.255100    
 C   -2.904200      -1.526600      0.3294000    
 C   -3.769700     -0.6682000     -0.5879000    
 C    1.000200      0.6282000     -7.6600000E-02
 C    2.064500     -0.1191000     -0.8528000    
 C    3.344000     -0.3714000     -8.3099999E-02
 C    4.461100      -1.034800     -0.8457000    
 H  -0.9803000       1.105200       1.514000    
 H   -1.606100       2.038900     -0.7490000    
 H   -2.952300       1.845300      0.3691000    
 H   -2.892400     -0.2388000       2.049800    
 H   -1.506500      -1.323100       1.958800    
 H   -2.242800     -3.5999999E-03  -1.957200    
 H   -3.627400       1.077300      -1.845200    
 H   -3.535800      -2.257100      0.8480000    
 H   -2.190200      -2.101700     -0.2717000    
 H   -4.585500     -0.2219000     -5.9000002E-03
 H   -4.233500      -1.299200      -1.354400    
 H  -0.2792000     -0.9649000     -0.4533000    
 H    1.687900      -1.088000      -1.196800    
 H    2.304000      0.4846000      -1.735200    
 H    5.338500      -1.136600     -0.2010000    
 H    4.142600      -2.028000      -1.171400    
 H    4.729400     -0.4219000      -1.709700    


%chk=000070805-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000070805

0 1
O 0.960387 2.323368 -0.354536
O 1.657001 -1.925920 -0.362189
N -0.048880 0.242295 -0.031006
C -1.279130 0.783491 0.593638
C -2.300338 1.243033 -0.484492
C -1.904618 -0.276955 1.532143
C -2.902798 0.049761 -1.261664
C -2.525267 -1.468634 0.759259
C -3.543361 -0.981273 -0.300277
C 0.972486 1.055442 -0.446023
C 2.188136 0.348198 -1.101963
C 2.544020 -1.066944 -0.647070
C 4.021492 -1.404170 -0.561691
H -0.969879 1.670613 1.177974
H -1.803164 1.956109 -1.167253
H -3.112543 1.798166 0.028153
H -2.701661 0.222570 2.117948
H -1.145334 -0.632456 2.255190
H -2.104141 -0.446468 -1.850176
H -3.653722 0.414435 -1.988712
H -3.015324 -2.157203 1.474163
H -1.729252 -2.059849 0.260233
H -4.406050 -0.509809 0.215349
H -3.941914 -1.842494 -0.870645
H 0.094693 -0.774296 -0.117792
H 1.974864 0.296369 -2.191280
H 3.050538 1.025865 -0.989812
H 4.162339 -2.482477 -0.392014
H 4.550698 -1.092231 -1.481222
H 4.481122 -0.842032 0.274770


