%chk=000093641.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093641

0 1
 O  -0.1136000     -7.1000002E-02 -0.5336000    
 O   -5.427200      0.3890000      0.8007000    
 O   -1.478900       1.618600      0.2526000    
 N   -3.633300      0.4766000     -0.7014000    
 C   -2.416700     -0.2472000     -0.9395000    
 C   -2.638300      -1.569800     -0.2310000    
 C   -3.626400      -1.238700      0.8870000    
 C    3.531500      0.4082000      0.2410000    
 C   -4.377700     -4.4700000E-02  0.3512000    
 C    2.265900     -0.2413000     -0.3164000    
 C   -1.311900      0.5571000     -0.3326000    
 C    4.808400     -0.3753000     -7.5999998E-02
 C    1.028000      0.5894000     -4.6999999E-03
 C    6.072200      0.2618000      0.5029000    
 C    7.317900     -0.5128000      9.9799998E-02
 H   -2.259300     -0.3456000      -2.017200    
 H   -3.110700      -2.279100     -0.9224000    
 H   -1.727400      -2.038300      0.1536000    
 H   -4.305100      -2.070800       1.088900    
 H   -3.107500     -0.9451000       1.804800    
 H   -3.906400       1.307800      -1.216700    
 H    3.626900       1.423100     -0.1647000    
 H    3.435400      0.5103000       1.329100    
 H    2.144100      -1.249800      9.7900003E-02
 H    2.353200     -0.3709000      -1.402200    
 H    4.709500      -1.396800      0.3118000    
 H    4.911000     -0.4596000      -1.165200    
 H   0.9142000      0.7003000       1.080100    
 H    1.118400       1.583000     -0.4595000    
 H    6.162100       1.295400      0.1493000    
 H    6.002700      0.2969000       1.596100    
 H    8.210100     -4.3099999E-02  0.5255000    
 H    7.271800      -1.545000      0.4615000    
 H    7.431900     -0.5343000     -0.9887000    


%chk=000093641-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093641

0 1
O -0.107540 -0.021974 -0.471522
O -5.731475 0.354208 0.513503
O -1.477357 1.668781 0.374259
N -3.761937 0.404112 -0.785811
C -2.459176 -0.250951 -0.882242
C -2.699343 -1.607560 -0.125515
C -3.872332 -1.306077 0.836837
C 3.624883 0.461446 0.256110
C -4.602144 -0.104988 0.205426
C 2.317675 -0.163857 -0.286227
C -1.336513 0.592272 -0.245343
C 4.878674 -0.361391 -0.116989
C 1.095979 0.673319 0.088314
C 6.190227 0.249021 0.427196
C 7.438616 -0.577245 0.049594
H -2.164589 -0.443768 -1.929984
H -2.996077 -2.372836 -0.862737
H -1.782997 -1.954697 0.375816
H -4.570304 -2.148557 0.962380
H -3.528780 -1.003036 1.843161
H -3.966972 1.298484 -1.232951
H 3.735767 1.493581 -0.136775
H 3.563737 0.552781 1.360574
H 2.196051 -1.187875 0.116595
H 2.373166 -0.255315 -1.388043
H 4.768613 -1.395813 0.270322
H 4.946237 -0.448286 -1.221493
H 0.966174 0.763139 1.182874
H 1.136448 1.692534 -0.338679
H 6.299062 1.283196 0.041276
H 6.122002 0.334759 1.530959
H 8.362210 -0.121126 0.450568
H 7.368941 -1.606539 0.449467
H 7.547873 -0.651439 -1.048922


