%chk=000201038.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201038

0 1
O 0.916519 3.406433 -0.267879
O -0.900828 2.644192 0.629496
O 4.415405 -0.769742 -0.756520
O 3.342504 -2.547598 -0.137615
N 0.146260 -0.015738 0.570941
N 0.226992 2.508008 0.176221
N 3.425152 -1.345532 -0.341466
C -2.157060 -0.596226 -0.146993
C -1.260809 -0.137829 1.013062
C -3.609043 -0.742526 0.324923
C -4.519161 -1.209764 -0.820279
C 0.805108 1.174548 0.164747
C 1.014523 -1.061903 0.424690
C 2.246733 -0.548405 -0.065619
C 2.115770 0.849452 -0.229804
C -5.966235 -1.358926 -0.358833
H -1.794137 -1.555642 -0.565587
H -2.104649 0.137025 -0.978970
H -1.614641 0.853965 1.406108
H -1.311126 -0.854300 1.865286
H -3.671194 -1.459839 1.166168
H -3.979612 0.224119 0.722113
H -4.468674 -0.489214 -1.661059
H -4.155182 -2.174413 -1.225769
H 0.784843 -2.096978 0.653885
H 2.872262 1.537539 -0.586019
H -6.610972 -1.689781 -1.181993
H -6.063804 -2.095477 0.446900
H -6.374543 -0.411147 0.011664


%chk=000201038-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201038

0 1
O 0.808508 3.347532 -0.567465
O -1.127173 2.460744 0.276136
O 4.587270 -0.639847 -0.635280
O 3.570344 -2.509294 0.217380
N 0.194196 -0.074888 0.568156
N 0.118787 2.365579 -0.087660
N 3.569941 -1.263588 -0.141004
C -2.179172 -0.536185 -0.169268
C -1.212375 -0.302147 1.010167
C -3.616573 -0.801577 0.332663
C -4.615644 -1.029921 -0.824737
C 0.787883 1.098483 0.044120
C 1.146573 -1.066610 0.550620
C 2.339214 -0.522739 0.026184
C 2.125200 0.843372 -0.295610
C -6.054193 -1.288549 -0.328467
H -1.826170 -1.394859 -0.774521
H -2.178966 0.356308 -0.822040
H -1.537797 0.569825 1.597721
H -1.190657 -1.188352 1.670129
H -3.625170 -1.687454 1.002091
H -3.958111 0.059653 0.942844
H -4.606727 -0.144399 -1.491518
H -4.274973 -1.887697 -1.439613
H 0.948451 -2.077107 0.898662
H 2.835094 1.552711 -0.711211
H -6.747672 -1.446849 -1.174112
H -6.098556 -2.186172 0.316672
H -6.431129 -0.431671 0.260760


