%chk=000130300.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130300

0 1
 O    4.813900     -0.3121000      0.8463000    
 O   -1.512600       1.196000      0.6138000    
 O   -3.207700     -0.9501000       1.864500    
 O   -4.418000      0.8247000       1.121400    
 N   -2.256000     -0.2422000      -1.060000    
 C    1.126700      0.6310000     -0.8101000    
 C  -0.1978000      0.9701000      -1.405300    
 C    1.823900       1.586200     -7.0600003E-02
 C    1.668300     -0.6414000     -0.9932000    
 C   -1.379200      0.6735000     -0.4902000    
 C    3.604800     -3.3000000E-03  0.3031000    
 C    3.063000       1.269000      0.4859000    
 C    2.907400     -0.9586000     -0.4365000    
 C   -3.394200     -0.6802000     -0.4495000    
 C    5.309400      -1.631000      0.6206000    
 C   -3.742100     -0.1675000      0.8969000    
 C   -4.209900      -1.564100      -1.037100    
 H  -0.3072000      0.4591000      -2.369900    
 H  -0.2417000       2.040200      -1.647100    
 H    1.412200       2.580500      8.0899999E-02
 H    1.132600      -1.394000      -1.565900    
 H    3.601400       2.017100       1.061400    
 H    3.269400      -1.965100     -0.6169000    
 H   -2.051400     -0.6185000      -1.982200    
 H    5.486100      -1.817800     -0.4441000    
 H    4.659300      -2.387800       1.072500    
 H    6.279700      -1.702100       1.123000    
 H   -3.995500      -1.966200      -2.022400    
 H   -5.115100      -1.909300     -0.5475000    
 H   -3.428000     -0.6245000       2.763300    


%chk=000130300-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130300

0 1
O 4.314221 -1.334579 0.934560
O -2.478991 1.296241 -1.875929
O -3.837685 1.362952 0.687669
O -5.238010 -0.344289 -0.048678
N -1.612339 -0.064909 -0.193770
C 1.051687 0.855289 -0.688559
C -0.131172 1.641119 -1.230001
C 1.483745 1.007817 0.658891
C 1.749877 -0.066024 -1.507701
C -1.507396 0.947578 -1.149082
C 3.249440 -0.651219 0.331856
C 2.565789 0.266918 1.169061
C 2.840310 -0.818382 -1.015562
C -2.825689 -0.737528 0.103066
C 5.070158 -2.280370 0.108390
C -4.086265 0.079644 0.189933
C -2.886361 -2.064884 0.396296
H 0.008948 1.903788 -2.292799
H -0.243556 2.598668 -0.684892
H 0.972398 1.725186 1.312568
H 1.440947 -0.197124 -2.551960
H 2.904611 0.387509 2.202400
H 3.357726 -1.515026 -1.681790
H -0.749048 -0.384879 0.254727
H 5.547216 -1.771273 -0.751430
H 4.424178 -3.102229 -0.257250
H 5.844665 -2.686743 0.774803
H -2.001086 -2.707601 0.352392
H -3.840150 -2.514906 0.680910
H -4.686470 1.880853 0.676981


