%chk=000166168.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166168

1 1
 O    4.250300      6.1099999E-02  3.8000001E-03
 O    3.886400      -2.175700      0.4071000    
 N    7.871600      0.9623000      2.3700001E-02
 N   -4.491400      -1.185700     -0.2802000    
 N    1.317800       1.742800     -0.5058000    
 C    6.369400       1.185800     -7.5199999E-02
 C    8.216200      0.4356000       1.409300    
 C    8.596700       2.279200     -0.2132000    
 C    8.304000     -5.0999999E-02  -1.026300    
 C    5.652500     -0.1341000      0.1307000    
 C   -5.073200     -0.2077000      -1.177700    
 C   -3.090700      -1.310900     -0.1714000    
 C   -5.367100      -2.042900      0.4939000    
 C   -5.246600       1.112000     -0.4786000    
 C    3.472100      -1.050600      0.1660000    
 C   -2.519100      -1.727800       1.030700    
 C   -2.277300      -1.018100      -1.266000    
 C  -0.3204000      -1.559300      4.3499999E-02
 C   -5.133400      -3.495800      0.1271000    
 C   -1.134000      -1.852100       1.138100    
 C  -0.8921000      -1.142200      -1.158500    
 C    2.030600     -0.6924000      3.4000000E-03
 C    1.140300      -1.690500      0.1567000    
 C   -6.433000       1.391700      0.1997000    
 C   -4.221200       2.057100     -0.5085000    
 C   -6.594000       2.616200      0.8478000    
 C   -4.381900       3.281600      0.1398000    
 C   -5.568400       3.561200      0.8179000    
 C    1.636000      0.6502000     -0.2778000    
 H    6.076600       1.923700      0.6814000    
 H    6.147100       1.609300      -1.062100    
 H    7.751900       1.084300       2.157900    
 H    7.881100     -0.5989000       1.515700    
 H    9.305400      0.4615000       1.518400    
 H    8.269700       2.994500      0.5473000    
 H    9.674100       2.105600     -0.1348000    
 H    8.340400       2.638900      -1.214100    
 H    7.992200      -1.056900     -0.7347000    
 H    7.879300      0.2382000      -1.992100    
 H    9.397500     -3.2299999E-02  -1.081600    
 H    5.936500     -0.8765000     -0.6197000    
 H    5.832400     -0.5402000       1.130200    
 H   -4.534000     -6.4400002E-02  -2.118400    
 H   -6.059000     -0.5569000      -1.516200    
 H   -6.418300      -1.807900      0.2864000    
 H   -5.243400      -1.883000       1.570700    
 H   -3.113500      -1.947000       1.912100    
 H   -2.667400     -0.7272000      -2.234600    
 H   -5.871300      -4.129400      0.6305000    
 H   -4.144300      -3.856900      0.4220000    
 H   -5.239600      -3.652000     -0.9521000    
 H  -0.7019000      -2.173800       2.082700    
 H  -0.2774000     -0.9275000      -2.029500    
 H    1.466700      -2.698100      0.4060000    
 H   -7.240700      0.6655000      0.2309000    
 H   -3.293300       1.857100      -1.036800    
 H   -7.517700       2.834000       1.375700    
 H   -3.583900       4.017900      0.1155000    
 H   -5.693700       4.514800       1.322300    


%chk=000166168-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166168

1 1
O 4.652441 -0.015019 -0.119775
O 4.022692 -1.867070 1.160117
N 8.335004 0.766681 -0.246551
N -4.431238 -1.120789 -0.065756
N 2.082488 1.617534 -1.498162
C 6.802663 0.782406 -0.458693
C 8.679832 0.933169 1.233666
C 8.923155 1.943777 -1.028474
C 8.943002 -0.533372 -0.772907
C 6.034423 -0.344510 0.247074
C -5.137845 -0.229663 -1.012644
C -3.054747 -1.140809 0.058521
C -5.309524 -2.029089 0.716196
C -5.743120 1.024830 -0.375913
C 3.667952 -0.903726 0.436253
C -2.389005 -2.152286 0.840212
C -2.223285 -0.144977 -0.574171
C -0.167116 -1.179318 0.322632
C -5.554981 -3.389178 0.026316
C -1.002011 -2.160802 0.960232
C -0.837142 -0.166490 -0.447901
C 2.315151 -0.504838 0.037888
C 1.249557 -1.287162 0.511957
C -6.913454 1.592527 -0.939474
C -5.144415 1.650884 0.745081
C -7.469862 2.773817 -0.400650
C -5.703886 2.829689 1.288360
C -6.865607 3.396416 0.716056
C 2.178974 0.649089 -0.798517
H 6.436321 1.758237 -0.097584
H 6.626164 0.725686 -1.546078
H 8.187270 1.840329 1.615333
H 8.330786 0.054933 1.794601
H 9.771852 1.027109 1.335456
H 8.485718 2.880168 -0.650230
H 10.015431 1.957629 -0.892678
H 8.678510 1.824839 -2.094859
H 8.589062 -1.378442 -0.165744
H 8.637324 -0.672518 -1.820979
H 10.039702 -0.464775 -0.707676
H 6.291619 -1.354289 -0.122276
H 6.143569 -0.335282 1.347336
H -4.450134 0.044421 -1.832016
H -5.946701 -0.818050 -1.487163
H -6.269173 -1.501060 0.861049
H -4.880550 -2.172050 1.723362
H -2.966359 -2.937684 1.333161
H -2.679027 0.671638 -1.140178
H -6.239816 -4.003580 0.637729
H -4.615487 -3.952069 -0.111507
H -6.019072 -3.254954 -0.967131
H -0.526469 -2.950448 1.555042
H -0.259428 0.620158 -0.939877
H 1.580135 -2.128309 1.140102
H -7.393418 1.111182 -1.801284
H -4.248004 1.216031 1.201553
H -8.374964 3.202219 -0.844614
H -5.234144 3.304386 2.156826
H -7.299214 4.309226 1.138352


