%chk=000281559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281559

0 1
O -5.147073 0.875587 0.823610
O 2.301729 2.189802 -0.564463
O 4.946210 0.773638 1.343644
O 5.774077 0.901100 -0.736608
O 1.652135 -2.293084 -0.305424
N 0.650595 0.578542 -0.714898
N 3.132917 -1.027046 0.878597
C -1.705237 0.690614 -0.074187
C -2.145270 -0.710410 -0.240557
C -2.828093 1.462826 0.360480
C -3.537054 -0.793591 0.084941
C -0.476097 1.328249 -0.262840
C -4.036782 0.562909 0.481079
C 2.936777 0.026385 -1.406331
C -2.744964 2.813218 0.608239
C 3.857365 -0.575163 -0.330096
C -0.387574 2.726264 -0.004309
C -1.462462 -1.849885 -0.628168
C -4.224853 -1.988166 0.013843
C 1.967934 1.058433 -0.852244
C -1.492705 3.443599 0.419022
C -2.167383 -3.070445 -0.700308
C -3.520894 -3.143478 -0.387792
C 4.952544 0.440626 0.013107
C 2.045365 -1.902780 0.786871
C 1.428004 -2.291902 2.093247
H 3.551113 0.517232 -2.199177
H 2.408605 -0.812095 -1.922344
H 4.377100 -1.474253 -0.786333
H -3.614034 3.382062 0.938292
H 0.470469 -0.421812 -0.930674
H 0.574359 3.237919 -0.144373
H -0.395393 -1.836869 -0.873175
H -5.286073 -2.038303 0.261524
H -1.402869 4.514267 0.609758
H -1.629073 -3.968347 -1.009311
H -4.047806 -4.093981 -0.452187
H 3.391407 -0.583983 1.764638
H 0.634306 -3.042449 1.929029
H 2.148987 -2.737063 2.793197
H 0.951914 -1.439429 2.601615
H 5.622480 1.473260 1.568665


%chk=000281559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281559

0 1
O -5.320125 0.970601 0.543750
O 2.396823 2.122181 -0.287725
O 5.151420 0.701532 1.271220
O 5.704108 0.961887 -0.973414
O 1.732167 -2.445082 -0.153663
N 0.609427 0.632103 -0.679533
N 3.255419 -1.030742 0.882192
C -1.773485 0.720074 -0.082150
C -2.221295 -0.696427 -0.278266
C -2.912622 1.501336 0.281633
C -3.639351 -0.741625 -0.082210
C -0.515514 1.363863 -0.208030
C -4.133161 0.626067 0.283626
C 2.870007 0.006061 -1.406376
C -2.835920 2.870061 0.569051
C 3.882730 -0.577345 -0.369296
C -0.423925 2.757276 0.102184
C -1.535411 -1.897331 -0.561500
C -4.377251 -1.927418 -0.197977
C 1.943942 1.028325 -0.743979
C -1.563907 3.490351 0.488763
C -2.282346 -3.101827 -0.681232
C -3.685790 -3.124902 -0.513251
C 4.990553 0.443478 -0.095168
C 2.232669 -1.952803 0.914516
C 1.727589 -2.346357 2.295326
H 3.454583 0.520036 -2.189454
H 2.318246 -0.832966 -1.855786
H 4.371152 -1.438150 -0.870547
H -3.737018 3.426154 0.845257
H 0.423721 -0.319456 -1.004221
H 0.551626 3.242188 0.034130
H -0.445919 -1.976958 -0.650220
H -5.460765 -1.913637 -0.039507
H -1.455261 4.555812 0.716677
H -1.746584 -4.032049 -0.899901
H -4.232559 -4.068302 -0.613987
H 3.616516 -0.618059 1.746072
H 1.878675 -3.430701 2.437547
H 2.225817 -1.805699 3.117304
H 0.641104 -2.160320 2.349406
H 5.844618 1.400767 1.406341


