%chk=000225190.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225190

0 1
O -0.198722 0.794670 1.073530
O 2.325735 -1.902128 -1.780477
O 5.937306 -0.574554 0.750664
N 0.736606 0.164863 -0.913482
N 4.038070 0.726579 0.811652
N 4.136543 -1.287374 -0.522532
N 2.123663 2.182134 0.797065
C -1.721231 0.096271 -0.705187
C -2.547489 1.367405 -0.733518
C -2.464424 -1.002376 0.031624
C -0.351496 0.352760 -0.062312
C 2.090541 0.058499 -0.447273
C 2.708267 0.980337 0.396635
C 2.785460 -1.106579 -0.981337
C 4.795614 -0.414258 0.363112
C -3.168678 1.751194 -1.931626
C -3.177158 -1.952643 -0.716335
C -2.712596 2.151015 0.417547
C -2.469345 -1.074205 1.431422
C 4.759332 1.685532 1.689470
C 4.899231 -2.481502 -0.980250
C -3.947108 2.911419 -1.973914
C -3.885096 -2.966196 -0.065071
C -3.491088 3.309548 0.368930
C -3.177722 -2.091038 2.076656
C -4.109883 3.692400 -0.825635
C -3.886737 -3.038320 1.331551
H -1.568867 -0.245676 -1.767090
H 0.600705 -0.264718 -1.837748
H -3.053773 1.148813 -2.830333
H -3.186363 -1.904398 -1.803286
H -2.224284 1.852844 1.349624
H -1.911727 -0.338201 2.018355
H 4.829072 2.681037 1.218785
H 5.799715 1.328722 1.862110
H 4.274535 1.758499 2.676707
H 5.940071 -2.205804 -1.223831
H 4.416247 -2.906892 -1.881323
H 4.914802 -3.253433 -0.192155
H -4.428826 3.205730 -2.904977
H -4.436436 -3.701759 -0.648570
H -3.617818 3.914020 1.265733
H -3.175758 -2.143869 3.164383
H 1.097237 2.230661 0.733362
H 2.460612 2.622158 1.644374
H -4.717449 4.594353 -0.860873
H -4.437594 -3.829244 1.836342


%chk=000225190-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225190

0 1
O -0.423726 1.020553 1.320542
O 2.230620 -1.436316 -2.095761
O 6.217617 -0.199752 0.041995
N 0.684463 -0.149176 -0.394562
N 4.172610 0.554928 0.921004
N 4.241254 -0.827908 -1.028774
N 2.140817 1.352854 1.854865
C -1.761885 -0.047094 -0.453001
C -2.517530 1.235641 -0.850748
C -2.615998 -1.012174 0.390448
C -0.433485 0.321231 0.241407
C 2.091035 -0.069588 -0.139473
C 2.764942 0.620353 0.886815
C 2.823909 -0.814628 -1.142023
C 4.954786 -0.165636 -0.025562
C -2.555659 1.623992 -2.212977
C -3.379696 -1.996665 -0.287989
C -3.167191 2.045723 0.113555
C -2.700947 -0.936141 1.804084
C 4.919078 1.259011 1.983883
C 5.033462 -1.580594 -2.027178
C -3.233313 2.799290 -2.610101
C -4.214877 -2.884124 0.425146
C -3.842004 3.221293 -0.281504
C -3.533308 -1.827753 2.518035
C -3.879594 3.602388 -1.643564
C -4.295317 -2.802260 1.834485
H -1.517422 -0.572847 -1.395557
H 0.552850 -0.721559 -1.248333
H -2.054770 1.005355 -2.968752
H -3.325307 -2.064438 -1.381830
H -3.140782 1.758021 1.168602
H -2.104354 -0.189551 2.337957
H 4.747263 2.349849 1.933122
H 5.986764 1.060612 1.811234
H 4.641618 0.875469 2.982657
H 5.712832 -0.897977 -2.563405
H 4.320329 -2.042439 -2.724961
H 5.639851 -2.350911 -1.523722
H -3.257294 3.084336 -3.667950
H -4.797454 -3.638021 -0.116262
H -4.341348 3.839734 0.472987
H -3.585825 -1.760084 3.610749
H 1.086221 1.367438 1.834963
H 2.666599 1.843756 2.572401
H -4.407615 4.513205 -1.947675
H -4.940523 -3.491101 2.391227


