%chk=000025073.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025073

0 1
 O    2.394500      0.7980000     -0.6571000    
 O   -5.205700      0.8292000      0.1947000    
 O    2.885300     -0.7755000      0.9827000    
 N   -3.007000     -0.1132000      0.2208000    
 N    4.582300      0.3363000     -0.1425000    
 C   -1.644800      0.1011000     -3.5999999E-03
 C  -0.8152000     -0.9414000     -0.4169000    
 C   0.5423000     -0.7074000     -0.6364000    
 C   -1.117000       1.377500      0.1901000    
 C    1.070200      0.5692000     -0.4426000    
 C   0.2404000       1.611700     -2.9400000E-02
 C   -1.354100      -2.318300     -0.6332000    
 C   -3.554000      -1.417200      0.6776000    
 C   -3.989500      0.8982000      3.1399999E-02
 C    3.266600      3.6800001E-02  0.1452000    
 C    5.705700     -0.2850000      0.5192000    
 H    1.187100      -1.515300     -0.9746000    
 H   -1.715700       2.209000      0.5500000    
 H   0.6483000       2.605800      0.1317000    
 H  -0.6045000      -2.918700      -1.168400    
 H   -1.519800      -2.867700      0.2948000    
 H   -2.208300      -2.325400      -1.314200    
 H   -2.883500      -1.889700       1.397900    
 H   -3.840100      -2.041300     -0.1699000    
 H   -4.482500      -1.234100       1.232400    
 H   -3.557000       1.830300     -0.3615000    
 H    4.771000       1.032100     -0.8575000    
 H    6.329300     -0.7606000     -0.2416000    
 H    5.377500      -1.029300       1.248500    
 H    6.281000      0.4970000       1.020700    


%chk=000025073-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025073

0 1
O 2.431141 0.740910 0.240347
O -5.201432 0.642984 -0.894838
O 3.379569 -1.396088 -0.275207
N -3.176153 -0.123786 0.032504
N 4.668974 0.513495 0.184838
C -1.738221 0.028377 0.063975
C -0.872629 -1.055450 -0.258866
C 0.530001 -0.855752 -0.200456
C -1.195502 1.290251 0.416360
C 1.051607 0.408103 0.157051
C 0.195589 1.490746 0.458328
C -1.411922 -2.407739 -0.687402
C -3.853203 -0.959246 1.045975
C -3.939689 0.635141 -0.852990
C 3.496876 -0.182209 0.017368
C 5.980051 -0.122357 0.030960
H 1.209701 -1.673833 -0.444427
H -1.875869 2.109534 0.672311
H 0.626990 2.459123 0.726431
H -0.686637 -2.931031 -1.332664
H -1.604444 -3.062277 0.184898
H -2.361867 -2.304605 -1.240299
H -3.571876 -0.633412 2.063370
H -3.593684 -2.025623 0.928340
H -4.939317 -0.833442 0.903662
H -3.303727 1.235580 -1.539789
H 4.596609 1.502708 0.423732
H 6.560416 0.350491 -0.782378
H 5.818120 -1.182093 -0.221081
H 6.563324 -0.066401 0.968245


