%chk=000205817.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205817

0 1
O 0.388643 1.694371 1.269399
O -1.892341 2.125670 -1.218115
O -4.967795 -1.215112 -0.672903
N 3.797295 -0.334264 -0.142554
C 2.709668 0.317763 0.654366
C 1.352824 -0.162674 0.114257
C 5.030406 0.519929 -0.197673
C 4.106568 -1.705869 0.385446
C 0.209063 0.692612 0.607177
C 4.797723 1.720591 -1.116036
C 4.819840 -2.529674 -0.688001
C -1.146306 0.217740 0.219847
C -2.063661 0.932873 -0.578073
C -1.556193 -1.029995 0.732018
C -3.344090 0.415485 -0.864253
C -2.810156 -1.565446 0.477292
C -3.700173 -0.823598 -0.329483
C -0.699274 2.920322 -1.016001
C -5.453636 -2.483584 -0.165989
H 2.770792 1.425695 0.541967
H 2.777897 0.122010 1.745193
H 1.188230 -1.229652 0.359521
H 1.371149 -0.146225 -1.000459
H 5.859429 -0.098111 -0.611557
H 5.360770 0.863390 0.806398
H 4.713675 -1.681980 1.316259
H 3.147443 -2.205560 0.646748
H 5.728669 2.269763 -1.288216
H 4.065979 2.421503 -0.697439
H 4.410060 1.396545 -2.091330
H 4.910303 -3.577469 -0.385749
H 5.826865 -2.149876 -0.895134
H 4.267167 -2.496002 -1.637079
H -0.861841 -1.592671 1.362410
H -4.036547 0.980364 -1.485746
H -3.092051 -2.524202 0.893972
H -0.603959 3.201574 0.042814
H 0.181847 2.385384 -1.378183
H -0.913429 3.797788 -1.639936
H -4.839051 -3.304487 -0.545818
H -6.465550 -2.519159 -0.591705
H -5.488656 -2.467163 0.927048


%chk=000205817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205817

0 1
O 0.405639 1.662625 1.306425
O -2.359016 2.495237 0.359328
O -5.089435 -1.220500 -0.527708
N 3.909846 -0.358009 -0.052868
C 2.769857 0.536875 0.286734
C 1.418263 -0.184820 0.095920
C 5.070636 0.374811 -0.626802
C 4.289060 -1.236307 1.087975
C 0.218029 0.674905 0.524681
C 4.848160 0.792328 -2.093180
C 4.992215 -2.533924 0.646066
C -1.143660 0.281893 0.059164
C -2.316774 1.121725 0.132226
C -1.357730 -1.080063 -0.314490
C -3.602096 0.565889 -0.055804
C -2.627995 -1.635418 -0.523627
C -3.767220 -0.798328 -0.364943
C -1.287940 3.391681 -0.107019
C -5.320001 -2.621577 -0.896405
H 2.796767 1.417679 -0.379312
H 2.837193 0.932775 1.324811
H 1.419792 -1.117001 0.698784
H 1.323848 -0.502889 -0.958411
H 5.947314 -0.296995 -0.585320
H 5.332556 1.273748 -0.012296
H 4.929045 -0.689751 1.826935
H 3.361689 -1.506155 1.627876
H 5.740780 1.313569 -2.487489
H 3.987510 1.477329 -2.200901
H 4.653151 -0.098955 -2.714748
H 5.228882 -3.163907 1.524070
H 5.940760 -2.330596 0.116622
H 4.340143 -3.106102 -0.036773
H -0.489929 -1.740304 -0.402139
H -4.474417 1.221037 0.005392
H -2.724351 -2.692212 -0.785705
H -0.497416 3.464579 0.655239
H -0.855036 3.024767 -1.057400
H -1.787001 4.360311 -0.267744
H -4.851097 -2.863381 -1.869501
H -6.412328 -2.718742 -0.976238
H -4.940096 -3.309227 -0.116723


