%chk=000078610.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078610

0 1
 O    1.224900      -3.239400     -0.5811000    
 O   -1.224600       3.239700     -0.5816000    
 O  -0.7465000      -3.620700      0.5711000    
 O   0.7464000       3.620700      0.5714000    
 N   -2.445900      -1.426800      6.2399998E-02
 N    2.446000       1.426800      6.1700001E-02
 C    1.299100     -0.7004000      6.1700001E-02
 C   -1.299100      0.7005000      6.1500002E-02
 C   -1.221100     -0.8128000      6.1500002E-02
 C    1.221100      0.8129000      6.1500002E-02
 C  -1.9900000E-02  -1.423000      6.1600000E-02
 C   1.9800000E-02   1.423100      6.1299998E-02
 C   8.4600002E-02  -2.893100      6.2300000E-02
 C  -8.4500000E-02   2.893200      6.2199999E-02
 C   -3.709600     -0.8326000      6.1600000E-02
 C    3.709600      0.8325000      6.1299998E-02
 C   -4.353800     -0.5288000       1.269300    
 C    4.354000      0.5298000       1.269100    
 C   -4.353600     -0.5311000      -1.146700    
 C    4.353300      0.5299000      -1.147000    
 C   -5.616200      6.4700000E-02   1.268700    
 C    5.616400     -6.3900001E-02   1.268800    
 C   -5.616100      6.2199999E-02  -1.147400    
 C    5.615700     -6.3500002E-02  -1.147200    
 C   -6.247400      0.3606000      6.0300000E-02
 C    6.247300     -0.3608000      6.0600001E-02
 C    1.469100      -4.647300     -0.6644000    
 C   -1.468600       4.647600     -0.6648000    
 H    1.859500      -1.033000      0.9453000    
 H    1.854600     -0.9955000     -0.8380000    
 H   -1.859600       1.033300      0.9451000    
 H   -1.854700      0.9955000     -0.8382000    
 H   -2.449300      -2.440700      5.5500001E-02
 H    2.449400       2.440800      5.4600000E-02
 H   -3.873400     -0.7540000       2.218600    
 H    3.873800      0.7559000       2.218300    
 H   -3.873100     -0.7582000      -2.095500    
 H    3.872700      0.7561000      -2.095900    
 H   -6.107700      0.2969000       2.209000    
 H    6.108100     -0.2951000       2.209200    
 H   -6.107400      0.2924000      -2.088200    
 H    6.106900     -0.2946000      -2.087900    
 H   -7.230200      0.8228000      5.9700001E-02
 H    7.230100     -0.8231000      6.0199998E-02
 H   0.6652000      -5.139300      -1.220400    
 H    2.409800      -4.797600      -1.200900    
 H    1.564400      -5.075300      0.3382000    
 H   -1.564400       5.075400      0.3377000    
 H  -0.6644000       5.139600      -1.220300    
 H   -2.409000       4.798000      -1.201600    


%chk=000078610-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078610

0 1
O 1.156580 -3.450550 -0.053293
O -1.156460 3.450532 -0.054213
O -1.131405 -3.511862 0.397313
O 1.131640 3.511849 0.395925
N -2.485498 -1.287923 -0.032219
N 2.485493 1.287894 -0.033053
C 1.228340 -0.780346 -0.720375
C -1.228437 0.780057 -0.720426
C -1.284024 -0.695607 -0.369338
C 1.283988 0.695413 -0.369754
C -0.091491 -1.434774 -0.341588
C 0.091463 1.434585 -0.342046
C -0.103543 -2.837362 0.026000
C 0.103644 2.837288 0.025053
C -3.812155 -0.781836 -0.049500
C 3.812152 0.781868 -0.050206
C -4.728045 -1.347414 0.882891
C 4.728199 1.348273 0.881543
C -4.288097 0.183494 -0.979134
C 4.287984 -0.184233 -0.979099
C -6.077840 -0.944916 0.896437
C 6.078008 0.945841 0.895203
C -5.639698 0.589137 -0.947855
C 5.639608 -0.589790 -0.947701
C -6.543153 0.034250 -0.013402
C 6.543207 -0.034088 -0.013877
C 1.196154 -4.874934 0.341567
C -1.195858 4.875060 0.340135
H 2.050137 -1.320146 -0.222354
H 1.410101 -0.901165 -1.811069
H -2.050166 1.319996 -0.222447
H -1.410351 0.900567 -1.811128
H -2.356060 -2.276745 0.285733
H 2.356060 2.276836 0.284555
H -4.367602 -2.095924 1.598076
H 4.367861 2.097396 1.596143
H -3.625745 0.591768 -1.745860
H 3.625557 -0.593198 -1.745391
H -6.765699 -1.391631 1.622887
H 6.765970 1.393214 1.621151
H -5.989371 1.333401 -1.672189
H 5.989177 -1.334661 -1.671462
H -7.591318 0.350736 0.000457
H 7.591382 -0.350534 0.000081
H 0.540082 -5.474561 -0.311892
H 2.249257 -5.167962 0.223052
H 0.865777 -4.995633 1.387182
H -0.865140 4.996140 1.385598
H -0.539976 5.474424 -0.313757
H -2.248989 5.168080 0.221845


