%chk=000028953.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028953

0 1
 O    5.530800     -0.6580000      0.5087000    
 O   -2.919500       2.359100     -0.1076000    
 N    2.970400      0.2681000     -0.3209000    
 N  -0.6994000      0.7723000     -7.1199998E-02
 C    3.114700     -0.8423000      0.6308000    
 C    4.118300       1.178800     -0.2097000    
 C    1.716300      0.9841000     -9.6900001E-02
 C    4.435500      -1.566200      0.3861000    
 C    5.415200      0.4070000     -0.4356000    
 C   0.5296000      5.2000001E-02 -0.3040000    
 C   -1.943100      0.1998000     -0.1524000    
 C   -3.064700       1.155900      0.1114000    
 C   -2.109900      -1.097100     -0.4604000    
 C   -4.317500      0.7001000      0.7616000    
 C   -3.320800      -1.841800     -0.6852000    
 C   -4.917300     -0.4878000      0.6458000    
 C   -4.538500      -1.584100     -0.2006000    
 H    2.338400      -1.601700      0.5105000    
 H    3.084200     -0.4712000       1.663400    
 H    4.139700       1.644400      0.7843000    
 H    4.045300       1.976800     -0.9573000    
 H    1.682500       1.422600      0.9098000    
 H    1.635700       1.817100     -0.8075000    
 H    4.573300      -2.354600       1.133200    
 H    4.461600      -2.039100     -0.6033000    
 H    5.473300      1.9000000E-03  -1.453300    
 H    6.273700       1.071500     -0.2943000    
 H   0.5504000     -0.3505000      -1.324400    
 H   0.5515000     -0.7781000      0.4063000    
 H  -0.6588000       1.761100      0.1554000    
 H   -1.238200      -1.722800     -0.6454000    
 H   -4.801900       1.456800       1.375700    
 H   -3.199400      -2.731700      -1.300300    
 H   -5.849500     -0.6375000       1.187300    
 H   -5.343900      -2.272900     -0.4471000    


%chk=000028953-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028953

0 1
O 5.783527 -0.544782 0.197985
O -2.552390 2.208319 0.972737
N 2.996296 0.215102 -0.142756
N -0.742718 0.608993 0.176530
C 3.408274 -0.782280 0.882308
C 4.097936 1.187982 -0.373789
C 1.706062 0.869298 0.162379
C 4.689163 -1.501044 0.428096
C 5.369410 0.443268 -0.812656
C 0.513523 -0.049485 -0.177933
C -1.999098 0.086940 0.043464
C -3.024307 1.080651 0.535365
C -2.212120 -1.205114 -0.489608
C -4.444972 0.825937 0.538069
C -3.423753 -1.911880 -0.694146
C -5.184463 -0.289379 0.128199
C -4.747375 -1.525240 -0.426198
H 2.605764 -1.530016 1.020779
H 3.593303 -0.290379 1.870525
H 4.323485 1.781160 0.547595
H 3.793693 1.892839 -1.170438
H 1.634012 1.188929 1.233252
H 1.629795 1.784957 -0.454453
H 5.056894 -2.187650 1.208314
H 4.484152 -2.068901 -0.505011
H 5.183534 -0.067774 -1.781887
H 6.220669 1.136248 -0.914602
H 0.546613 -0.287999 -1.260058
H 0.601278 -1.011095 0.369180
H -0.767036 1.564891 0.580561
H -1.307100 -1.746856 -0.793663
H -5.011153 1.676676 0.940232
H -3.300048 -2.914032 -1.128831
H -6.272273 -0.192812 0.254855
H -5.530577 -2.253473 -0.671493


