%chk=000286476.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286476

0 1
O -1.114160 2.941056 0.625057
O -2.351149 -2.765093 2.546050
O -1.125039 0.167115 -3.709043
O -2.906837 -3.826300 0.740644
O -1.658535 -1.926902 -3.579829
N 2.831736 1.625280 0.388845
N 0.068141 1.721529 2.167159
N 2.723882 1.142953 -1.858918
N 2.045175 -0.591515 1.277710
N 1.567864 -2.194756 -0.511138
N 1.716228 -1.653986 -2.809483
N -2.458892 -2.865590 1.336266
N -1.426805 -0.835544 -3.089525
C 3.014856 2.412474 1.624538
C 1.886257 3.430645 1.837800
C 0.737756 2.920101 2.724439
C 2.381356 0.309158 0.290327
C 2.321461 0.020696 -1.120448
C 3.014291 2.087394 -0.956946
C -0.751934 1.856920 1.045349
C -1.179579 0.559321 0.410689
C 1.890830 -1.287404 -1.501285
C -1.135514 0.474126 -0.988465
C -1.625416 -0.522484 1.173577
C -2.000122 -1.711853 0.523904
C -1.507515 -0.726911 -1.612510
C 1.671527 -1.807543 0.799765
C -1.939167 -1.835051 -0.869345
H 3.997827 2.936102 1.560105
H 3.087254 1.706482 2.488519
H 2.305160 4.350145 2.295993
H 1.465714 3.763506 0.862089
H -0.022025 3.733595 2.836821
H 1.102183 2.666905 3.744501
H 3.357602 3.090787 -1.171645
H 0.528177 0.827684 2.369726
H -0.811059 1.336634 -1.594327
H -1.689032 -0.460412 2.270093
H 1.413452 -2.579609 1.547531
H -2.220206 -2.777984 -1.369113
H 2.045101 -1.045874 -3.550079
H 1.505654 -2.614796 -3.047695


%chk=000286476-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286476

0 1
O -1.649737 3.030483 0.561592
O -1.206393 -3.179379 1.821288
O -4.049794 0.982150 -3.257986
O -2.627173 -4.084681 0.283550
O -4.488001 -1.257269 -3.242011
N 3.367376 1.584231 0.605137
N -0.000892 1.733433 1.596042
N 4.384063 0.698867 -1.262622
N 1.950258 -0.373773 1.237647
N 2.313990 -2.292883 -0.255207
N 3.745356 -2.205799 -2.130227
N -1.994747 -3.090710 0.800820
N -3.936502 -0.198239 -2.755590
C 3.140342 2.527770 1.721582
C 1.886682 3.437472 1.603497
C 0.602651 2.890572 2.274232
C 2.865068 0.286797 0.460022
C 3.510984 -0.242954 -0.690628
C 4.270819 1.770137 -0.458610
C -1.112126 1.899342 0.799316
C -1.706431 0.641372 0.200443
C 3.197700 -1.588549 -1.043513
C -2.506599 0.786892 -0.957511
C -1.545406 -0.636406 0.781334
C -2.173446 -1.748878 0.182599
C -3.107306 -0.352538 -1.525274
C 1.749646 -1.665791 0.814498
C -2.961940 -1.640979 -0.976329
H 4.046832 3.155773 1.779658
H 3.093484 1.934681 2.654094
H 2.126396 4.395673 2.104982
H 1.685663 3.675880 0.543089
H -0.159925 3.688133 2.284579
H 0.826260 2.607803 3.321572
H 4.817537 2.702831 -0.584718
H 0.532394 0.836434 1.621999
H -2.660464 1.780636 -1.387831
H -0.972050 -0.782885 1.699946
H 1.050187 -2.267662 1.403466
H -3.442520 -2.512379 -1.427400
H 4.402921 -1.703040 -2.723334
H 3.491341 -3.171567 -2.330490


