%chk=000214449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214449

0 1
O -2.230622 -0.149389 0.609998
N -0.941231 -2.012606 0.463903
N -3.204926 -3.614822 1.693960
C -0.950306 0.245708 0.172361
C -0.156297 -0.888779 0.092579
C -0.797026 1.665390 -0.090881
C 1.251208 -1.036350 -0.274000
C -2.144394 -1.548251 0.763279
C -3.394891 -2.225387 1.224048
C -1.538476 2.604356 0.648093
C 0.087737 2.101791 -1.092790
C 1.670974 -2.150318 -1.020770
C 2.189638 -0.070537 0.129007
C -1.385513 3.968209 0.391157
C 0.234203 3.468065 -1.340742
C 3.016002 -2.285210 -1.372719
C 3.532264 -0.214597 -0.226865
C -0.499043 4.401704 -0.600430
C 3.947068 -1.318417 -0.979608
H -3.862450 -1.625779 2.045421
H -4.140207 -2.227548 0.387660
H -2.231595 2.260337 1.416432
H 0.654701 1.374330 -1.675996
H 0.943998 -2.908940 -1.314391
H 1.871339 0.784666 0.724772
H -1.958984 4.695333 0.964689
H 0.920643 3.806337 -2.116149
H 3.339443 -3.148433 -1.952470
H 4.258417 0.533648 0.086877
H -0.381251 5.466203 -0.797738
H 4.994356 -1.426971 -1.255238
H -2.547274 -3.645759 2.470665
H -2.810004 -4.193387 0.953786


%chk=000214449-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214449

0 1
O -2.201805 -0.094927 0.722855
N -0.929098 -1.967030 0.462524
N -3.175367 -3.716289 1.349209
C -0.924236 0.324361 0.235239
C -0.142405 -0.829123 0.103008
C -0.797138 1.755953 -0.051369
C 1.274310 -1.023224 -0.259393
C -2.113609 -1.503891 0.823108
C -3.330069 -2.257853 1.320885
C -1.582832 2.698195 0.671660
C 0.066487 2.229978 -1.079166
C 1.679940 -2.274449 -0.800642
C 2.261435 -0.023874 -0.036232
C -1.490205 4.076131 0.387965
C 0.156582 3.609178 -1.356458
C 3.029195 -2.508514 -1.137763
C 3.610678 -0.262036 -0.371777
C -0.616513 4.540400 -0.623101
C 4.001506 -1.501980 -0.930491
H -3.580024 -1.897133 2.337140
H -4.197407 -1.993081 0.686920
H -2.262570 2.339715 1.451076
H 0.649738 1.517826 -1.671228
H 0.924083 -3.053533 -0.939964
H 1.979386 0.929843 0.421598
H -2.099146 4.788085 0.955952
H 0.822414 3.956557 -2.154151
H 3.323622 -3.476494 -1.558550
H 4.359440 0.516374 -0.186656
H -0.544542 5.611337 -0.842078
H 5.050116 -1.683951 -1.190860
H -2.420576 -4.022176 1.973663
H -3.043889 -4.119779 0.414976


