%chk=000010156.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010156

0 1
 O   0.5814000      -2.034300      -1.324500    
 O    3.314500      -2.010000      -1.204300    
 O    4.610400     -0.5001000      0.7151000    
 O   -4.757300     -0.2284000      -1.509900    
 O   -5.287100      -2.137600      0.4447000    
 O  -0.3203000       4.602000     -0.5724000    
 N  -0.1588000       2.280300     -0.5814000    
 C   -1.075100       2.016300      0.5100000    
 C  -0.4040000       2.225100       1.886000    
 C   0.3216000       1.036900       2.527200    
 C   -1.789600      0.6840000      0.2669000    
 C    1.115100      0.2137000       1.548900    
 C   0.4485000     -0.5631000      0.5794000    
 C   -1.042000     -0.5574000      0.5239000    
 C    1.198000      -1.305300     -0.3471000    
 C    2.515700      0.2235000       1.582300    
 C   -3.035100      0.7395000     -0.2411000    
 C   -1.601100      -1.747700      0.8166000    
 C    2.591800      -1.287600     -0.3009000    
 C    3.249000     -0.5260000      0.6626000    
 C   -3.963700     -0.3639000     -0.5808000    
 C   0.1363000       3.555500      -1.025000    
 C   -2.993200      -2.095200      0.9292000    
 C   -4.039400      -1.552400      0.3007000    
 C    1.134800       3.546200      -2.151400    
 C   0.3295000      -1.371800      -2.560000    
 C    3.650800      -3.347100     -0.8421000    
 C    5.269300      0.5050000     -5.2600000E-02
 H   -1.821100       2.822400      0.4512000    
 H   -1.172900       2.550900       2.599800    
 H   0.3041000       3.061700       1.815600    
 H  -0.4018000      0.3861000       3.036000    
 H   0.9727000       1.411300       3.327500    
 H   0.3036000       1.497000      -1.033400    
 H    3.038700      0.8207000       2.325800    
 H   -3.455800       1.714000     -0.4878000    
 H  -0.9559000      -2.596600       1.049700    
 H   -3.161100      -2.975700       1.549000    
 H    1.228900       4.552100      -2.569600    
 H    2.108500       3.221200      -1.774200    
 H   0.8047000       2.866200      -2.942100    
 H  -0.3477000     -0.5244000      -2.418300    
 H  -0.1457000      -2.085100      -3.239000    
 H    1.264800      -1.029700      -3.014300    
 H    2.746200      -3.942200     -0.6815000    
 H    4.271900      -3.357700      5.9099998E-02
 H    4.219600      -3.791400      -1.663400    
 H    4.975900       1.502600      0.2895000    
 H    5.039400      0.3902000      -1.116600    
 H    6.347700      0.3906000      8.6400002E-02
 H   -5.209300      -2.906300       1.035300    


%chk=000010156-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000010156

0 1
O 0.735887 -1.832660 -1.352071
O 3.537859 -1.784831 -1.081471
O 4.704851 -0.304334 1.145746
O -5.518868 0.496948 0.673415
O -5.363624 -2.100524 0.210742
O -1.431618 3.706623 -1.703742
N -0.047539 2.321826 -0.438132
C -1.033618 2.140311 0.647258
C -0.404707 2.357629 2.057167
C 0.223292 1.081185 2.685104
C -1.801553 0.797849 0.557054
C 1.087880 0.318966 1.696695
C 0.463107 -0.394559 0.622631
C -1.034005 -0.440782 0.499377
C 1.309035 -1.078332 -0.299717
C 2.493614 0.352926 1.803667
C -3.187621 0.936931 0.558615
C -1.594961 -1.714414 0.345734
C 2.726746 -1.071204 -0.166899
C 3.327297 -0.327941 0.885680
C -4.338134 0.024456 0.536360
C -0.326287 3.103189 -1.552483
C -2.949456 -2.148385 0.242847
C -4.146313 -1.438595 0.320941
C 0.798954 3.197376 -2.581284
C 0.933670 -1.251125 -2.701909
C 3.449711 -3.260705 -0.940856
C 5.619244 0.007373 0.023073
H -1.764203 2.948979 0.472347
H -1.194145 2.729342 2.737397
H 0.354157 3.158356 1.969383
H -0.594124 0.425991 3.041933
H 0.816354 1.369726 3.571188
H 0.855175 1.851631 -0.365352
H 2.975593 0.899286 2.620585
H -3.560031 1.970891 0.595956
H -0.870356 -2.533672 0.294281
H -3.054747 -3.237118 0.102259
H 0.407152 2.898818 -3.568809
H 1.122583 4.249430 -2.665603
H 1.676033 2.572830 -2.335885
H 0.428501 -0.269030 -2.767114
H 0.461320 -1.959790 -3.398698
H 2.011193 -1.151926 -2.924267
H 2.413385 -3.598630 -1.115541
H 3.792172 -3.566379 0.064949
H 4.122496 -3.669088 -1.710327
H 5.438327 1.039646 -0.333856
H 5.488680 -0.708344 -0.803967
H 6.629098 -0.065991 0.453668
H -5.232057 -3.072159 0.056630


