%chk=000205835.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205835

0 1
O -3.723685 1.949672 0.741845
O 0.426489 -1.613701 0.699681
O -3.443246 -2.480313 -0.542730
O 4.667939 0.530980 -0.512908
N -1.880189 -0.726266 -0.739573
N -3.933285 -0.294927 0.184357
C -1.790123 0.684913 -0.235382
C -0.800770 0.821248 0.942271
C -3.242410 0.939620 0.300525
C -1.505668 1.633488 -1.390242
C 0.635806 0.704281 0.535938
C -3.104848 -1.333180 -0.378782
C 1.272315 -0.555930 0.439812
C 1.405590 1.846104 0.266366
C 2.621949 -0.695445 0.095943
C 2.748484 1.753534 -0.084003
C 3.343434 0.478026 -0.162280
C 0.970511 -2.956978 0.692028
C 5.401013 -0.713957 -0.624837
H -1.028245 0.050415 1.714392
H -0.979179 1.798217 1.444796
H -1.022785 -1.284396 -0.771635
H -0.491168 1.485178 -1.787147
H -2.198973 1.477544 -2.228616
H -1.591996 2.681825 -1.074923
H -4.909586 -0.438108 0.423613
H 0.938725 2.831658 0.335329
H 3.089104 -1.668209 0.032777
H 3.345777 2.637428 -0.292562
H 1.737661 -3.058592 1.464799
H 1.351357 -3.207368 -0.301969
H 0.082419 -3.557094 0.937669
H 6.401376 -0.357812 -0.906523
H 4.971162 -1.337720 -1.413488
H 5.425944 -1.227935 0.340060


%chk=000205835-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205835

0 1
O -3.600397 2.240582 0.542278
O 0.466507 -1.671857 0.411038
O -3.887420 -2.420712 -0.128625
O 4.798815 0.621018 -0.363074
N -2.107136 -0.861890 -0.437328
N -4.099176 -0.060133 0.217479
C -1.869308 0.583176 -0.220823
C -0.831334 0.844702 0.928634
C -3.278137 1.066817 0.235528
C -1.489161 1.317921 -1.527481
C 0.636416 0.727043 0.545098
C -3.393862 -1.266136 -0.129510
C 1.285972 -0.519243 0.322932
C 1.439727 1.890508 0.434689
C 2.666872 -0.606552 0.023515
C 2.812465 1.842046 0.131506
C 3.427734 0.585069 -0.071461
C 1.108890 -2.991801 0.410387
C 5.487860 -0.652780 -0.578742
H -1.071432 0.147831 1.754429
H -1.021370 1.870937 1.293238
H -1.314410 -1.512040 -0.420575
H -0.501272 0.981550 -1.885223
H -2.236809 1.116950 -2.313660
H -1.449263 2.406441 -1.347472
H -5.090503 -0.064011 0.457673
H 0.967492 2.864955 0.605644
H 3.137384 -1.578805 -0.138421
H 3.418190 2.748864 0.057064
H 1.853244 -3.067320 1.224738
H 1.589369 -3.205274 -0.563645
H 0.292230 -3.708224 0.583986
H 6.533002 -0.381588 -0.786940
H 5.066173 -1.198091 -1.445944
H 5.443544 -1.293755 0.323670


