%chk=000089063.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089063

0 1
 O   -1.563200      -2.400000      0.3694000    
 O   -2.914100       2.730700     -0.2689000    
 N   0.9093000      -1.810200      0.8760000    
 N    3.242000      0.1700000       2.409100    
 C  -0.8387000     -0.1417000      0.3811000    
 C   -1.202600       1.196000      0.2130000    
 C   0.4852000     -0.4708000      0.6958000    
 C   -3.234400     -0.8544000     -0.1035000    
 C   -3.598300      0.4833000     -0.2719000    
 C   -1.841300      -1.215700      0.2293000    
 C    1.438600      0.5374000      0.8415000    
 C   -2.595600       1.557300     -0.1200000    
 C  -0.2427000       2.204600      0.3602000    
 C    1.075400       1.872200      0.6741000    
 C    2.828000      0.2377000       1.168300    
 C   -4.194300      -1.863000     -0.2506000    
 C   -4.922000      0.8124000     -0.5874000    
 C    3.842100     -2.7999999E-03  8.9400001E-02
 C   -5.512300      -1.530600     -0.5652000    
 C   -5.875300     -0.1957000     -0.7331000    
 C    3.674400      0.6325000      -1.115600    
 C    4.891000     -0.8466000      0.3574000    
 C    4.617500      0.4091000      -2.118800    
 C    5.834100      -1.069800     -0.6459000    
 C    5.697200     -0.4419000      -1.884000    
 H  -0.5008000       3.252800      0.2354000    
 H    1.808300       2.667200      0.7885000    
 H   -3.939400      -2.911900     -0.1253000    
 H   -5.230400       1.845600     -0.7235000    
 H    1.867800      -2.023000       1.115600    
 H   0.2544000      -2.573200      0.7810000    
 H   -6.256500      -2.313500     -0.6792000    
 H   -6.902100      6.0300000E-02 -0.9778000    
 H    2.852900       1.305500      -1.330500    
 H    5.008700      -1.381300       1.293800    
 H    4.245700      4.9000001E-03   2.497800    
 H    4.512200      0.8988000      -3.082600    
 H    6.670400      -1.739400     -0.4666000    
 H    6.430600     -0.6171000      -2.665600    


%chk=000089063-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089063

0 1
O -1.220670 -2.264183 -0.418995
O -3.248929 2.756743 0.673057
N 1.162479 -1.470199 0.241468
N 3.490873 1.394302 2.126687
C -0.772361 0.012110 0.290043
C -1.316923 1.305760 0.584050
C 0.653241 -0.216246 0.459879
C -3.111475 -0.788632 -0.339365
C -3.655974 0.496807 -0.060164
C -1.655172 -1.072333 -0.164933
C 1.492181 0.881027 0.897180
C -2.776891 1.601920 0.416808
C -0.486682 2.344776 1.046991
C 0.896774 2.122168 1.200839
C 2.972892 0.756971 1.094104
C -3.965773 -1.825554 -0.790604
C -5.042632 0.731008 -0.234125
C 3.811164 -0.006544 0.101667
C -5.343658 -1.586163 -0.962189
C -5.884843 -0.304617 -0.683284
C 3.568813 0.103018 -1.294970
C 4.907667 -0.793342 0.551136
C 4.419131 -0.539812 -2.219807
C 5.747561 -1.448023 -0.375078
C 5.509074 -1.318043 -1.763623
H -0.939736 3.314534 1.269613
H 1.554027 2.917466 1.564916
H -3.523414 -2.804762 -0.996520
H -5.429156 1.730203 -0.009937
H 2.160587 -1.652445 0.320902
H 0.486250 -2.191577 -0.068809
H -5.998958 -2.391586 -1.310920
H -6.956432 -0.122051 -0.816788
H 2.722018 0.701172 -1.649388
H 5.088365 -0.905303 1.627302
H 4.532100 1.326468 2.147048
H 4.230882 -0.436575 -3.293899
H 6.582030 -2.060390 -0.016602
H 6.163369 -1.822373 -2.482992


