%chk=000225009.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225009

0 1
O -0.448594 2.994228 0.195696
O 2.042513 1.551296 0.261771
N 3.135564 -0.890785 -0.570899
C -3.037220 -1.078113 -0.088778
C -1.658400 -0.414751 -0.008945
C -3.662700 -1.024339 1.319412
C -2.946357 -2.546467 -0.548542
C -3.930307 -0.319774 -1.091402
C -0.478953 -1.161918 0.044247
C 0.779915 -0.543871 0.143506
C -1.578039 0.985906 0.055869
C 2.005998 -1.416678 0.270399
C 0.859321 0.856917 0.179112
C -0.336394 1.623508 0.144984
C 2.836297 -1.036409 -2.026052
C 4.412184 -1.582799 -0.223232
C 0.768314 3.777376 0.294897
H -3.765448 0.007534 1.673075
H -3.043329 -1.555732 2.049706
H -4.657800 -1.478467 1.332122
H -2.378678 -3.160527 0.157965
H -3.942695 -2.993133 -0.633621
H -2.466691 -2.627396 -1.529659
H -3.457816 -0.264469 -2.078018
H -4.128373 0.707586 -0.766358
H -4.899778 -0.812478 -1.212913
H -0.521883 -2.249214 0.016702
H -2.476099 1.603356 0.035178
H 2.332519 -1.401646 1.338323
H 1.756828 -2.475295 0.036306
H 3.630121 -0.542529 -2.608144
H 2.743873 -2.075071 -2.374453
H 1.889350 -0.515251 -2.253885
H 5.230419 -1.149457 -0.821605
H 4.651489 -1.395773 0.836073
H 4.406903 -2.670027 -0.390384
H 2.832125 0.944552 0.035957
H 1.392431 3.612530 -0.589137
H 1.313381 3.511166 1.206886
H 0.375106 4.798215 0.335737


%chk=000225009-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225009

0 1
O -0.270459 3.001827 -0.015689
O 2.186249 1.395847 -0.039310
N 3.171405 -0.869219 -0.739145
C -3.086305 -1.069073 -0.050060
C -1.669763 -0.447233 -0.016757
C -3.878962 -0.629295 1.217912
C -3.049710 -2.619020 -0.082319
C -3.841629 -0.574441 -1.320523
C -0.484296 -1.221349 -0.016925
C 0.793900 -0.617249 0.014582
C -1.524142 0.964434 0.021581
C 2.061226 -1.456614 0.097724
C 0.922869 0.802656 0.013356
C -0.263101 1.595059 0.036336
C 2.905386 -1.006149 -2.197640
C 4.502991 -1.405563 -0.361338
C 0.675647 3.726189 0.858453
H -3.967101 0.469930 1.280139
H -3.374596 -0.979824 2.137229
H -4.901603 -1.052328 1.198446
H -2.553954 -3.034860 0.814654
H -4.082334 -3.013484 -0.108537
H -2.523540 -2.996471 -0.978939
H -3.313027 -0.889714 -2.238965
H -3.923092 0.526817 -1.340549
H -4.865924 -0.993078 -1.346779
H -0.540047 -2.315153 -0.035126
H -2.397168 1.626121 0.029477
H 2.438707 -1.465133 1.140410
H 1.858201 -2.510463 -0.194013
H 3.663421 -0.439305 -2.764644
H 2.931123 -2.068799 -2.524475
H 1.911005 -0.589062 -2.426211
H 5.283623 -0.914411 -0.967142
H 4.700856 -1.191208 0.703101
H 4.574565 -2.504481 -0.521621
H 2.843833 0.606020 -0.327999
H 1.715329 3.439137 0.635453
H 0.447877 3.519239 1.922947
H 0.501639 4.791504 0.640800


