%chk=000289069.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289069

0 1
O 0.495599 0.398715 1.925700
O -0.731109 -2.379647 -1.580709
O -4.847143 1.229160 -0.765773
N 1.216166 -1.138501 -1.197039
N -0.391829 -1.153480 0.425461
N -2.583417 -0.192571 0.199180
C 1.766430 -0.239567 -0.132007
C 1.975125 1.184795 -0.669597
C 2.991374 -0.906553 0.516499
C 3.375052 1.458756 -1.229789
C 3.755672 0.024608 1.464609
C 0.581774 -0.223541 0.898724
C 4.359726 1.929221 -0.149911
C 4.871156 0.802687 0.755638
C -0.057227 -1.644354 -0.894950
C -1.790036 -1.209269 0.940629
C -3.480966 -0.803419 -0.830157
C -3.332677 0.737769 1.098177
C -4.134338 0.327130 -1.638622
C -3.989955 1.823543 0.229047
H 1.762205 1.908611 0.149727
H 1.212926 1.401283 -1.446830
H 3.672246 -1.276116 -0.277789
H 2.669375 -1.816909 1.062965
H 3.298750 2.242205 -2.011111
H 3.771843 0.564059 -1.744765
H 4.198089 -0.578296 2.282723
H 3.052912 0.723952 1.964483
H 1.703413 -1.314347 -2.061569
H 3.885206 2.716318 0.469605
H 5.226494 2.418222 -0.638023
H 5.497964 0.105067 0.166385
H 5.548436 1.237350 1.518635
H -1.742646 -0.996521 2.037178
H -2.152795 -2.256053 0.791729
H -4.265879 -1.452132 -0.386016
H -2.857429 -1.444327 -1.500451
H -2.610256 1.205504 1.803565
H -4.108729 0.220306 1.702224
H -3.389647 0.901011 -2.217490
H -4.935169 -0.043447 -2.302073
H -4.692603 2.449529 0.806202
H -3.236278 2.453947 -0.275013


%chk=000289069-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289069

0 1
O 0.338142 0.573529 1.720258
O -0.588133 -2.530654 -1.692958
O -4.979641 1.322777 -0.588079
N 1.335913 -1.207020 -1.205578
N -0.411629 -1.082319 0.203738
N -2.741386 -0.306174 0.182456
C 1.782560 -0.239351 -0.171603
C 2.063892 1.176656 -0.759280
C 2.972035 -0.847864 0.639649
C 3.501270 1.432705 -1.281443
C 3.729930 0.129188 1.573415
C 0.508842 -0.169710 0.718267
C 4.474116 1.931413 -0.182428
C 4.891144 0.877479 0.870143
C 0.061548 -1.706247 -1.000943
C -1.792799 -1.272678 0.715159
C -3.721002 -0.808081 -0.806577
C -3.316835 0.665953 1.137713
C -4.358470 0.384184 -1.540171
C -3.964548 1.822423 0.356440
H 1.838895 1.915758 0.033463
H 1.324350 1.344709 -1.565206
H 3.690118 -1.276439 -0.089187
H 2.577101 -1.705179 1.217811
H 3.445044 2.208706 -2.069604
H 3.915237 0.528337 -1.774456
H 4.159859 -0.460335 2.406415
H 3.019496 0.840415 2.036638
H 1.910909 -1.513555 -1.987854
H 3.998401 2.792469 0.330605
H 5.392209 2.324466 -0.663765
H 5.547630 0.122464 0.387906
H 5.511755 1.380434 1.638566
H -1.722810 -1.193276 1.815474
H -2.070834 -2.306815 0.438453
H -4.530230 -1.404156 -0.317729
H -3.199488 -1.458947 -1.532040
H -2.508147 1.059032 1.780726
H -4.091976 0.194024 1.790005
H -3.580034 0.913274 -2.131458
H -5.174566 0.056175 -2.204892
H -4.502348 2.509643 1.030326
H -3.177716 2.377284 -0.198977


