%chk=000206614.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206614

0 1
O -0.054460 0.981551 1.583733
O -2.823154 1.431975 -1.773379
O 6.875078 1.067524 0.112136
N -0.471055 -0.350799 -0.225742
N 5.923740 -1.035090 0.161643
N -2.204590 2.236242 0.269018
N -2.545676 3.581606 -0.020365
C 1.823703 -0.106988 0.553627
C 4.551020 -0.678316 0.298885
C 2.253879 -1.438551 0.469024
C 2.764387 0.935980 0.530529
C -1.898591 -0.147606 -0.203926
C 0.384915 0.239350 0.720548
C 3.608230 -1.732370 0.340834
C 4.121384 0.658857 0.395307
C -4.202405 -1.045218 0.182210
C -2.733904 -1.130708 0.164867
C -4.892369 -1.491767 1.323656
C -4.921345 -0.560221 -0.921076
C -2.344416 1.220527 -0.666926
C -6.287073 -1.443686 1.358277
C -6.317822 -0.523205 -0.881360
C -7.002188 -0.962687 0.255495
C 7.021487 -0.134183 0.079191
C 8.349434 -0.822374 -0.052462
H 1.529314 -2.253133 0.515664
H 2.426096 1.972365 0.624131
H 3.929554 -2.769089 0.279436
H 4.849332 1.479715 0.370600
H -0.112688 -0.923459 -0.988335
H -2.333287 -2.096916 0.498026
H 6.119296 -2.038420 0.123824
H -4.339773 -1.863952 2.184665
H -4.388774 -0.201877 -1.808656
H -6.819416 -1.781475 2.245970
H -6.871476 -0.146071 -1.740382
H -8.089728 -0.929699 0.284516
H -1.671497 2.126099 1.153233
H 8.423425 -1.432776 -0.962688
H 9.154879 -0.068329 -0.111443
H 8.582378 -1.463561 0.808642
H -3.570191 3.656994 -0.105702
H -2.172755 3.851939 -0.942844


%chk=000206614-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206614

0 1
O 0.101206 1.741591 1.072938
O -3.307868 1.492541 -1.907972
O 7.098309 0.785054 0.953482
N -0.561919 -0.036003 -0.284904
N 5.881321 -1.084379 0.214324
N -2.006207 2.636250 -0.364774
N -2.258704 3.881040 -1.010554
C 1.808394 0.188190 0.338321
C 4.543800 -0.614855 0.275900
C 2.165667 -1.127535 -0.062375
C 2.843064 1.079506 0.722924
C -2.000648 0.195969 -0.269766
C 0.397595 0.687637 0.409229
C 3.512836 -1.523626 -0.094437
C 4.196106 0.700184 0.693782
C -4.230506 -1.032845 0.315599
C -2.774644 -0.831679 0.210931
C -4.667369 -2.041466 1.228346
C -5.219934 -0.324620 -0.429661
C -2.502132 1.477123 -0.906698
C -6.036061 -2.311623 1.421963
C -6.588971 -0.603889 -0.236145
C -7.007188 -1.588444 0.689866
C 7.068232 -0.406769 0.537955
C 8.326233 -1.251003 0.338384
H 1.403592 -1.873553 -0.318541
H 2.558316 2.084298 1.050554
H 3.769009 -2.546766 -0.397853
H 4.984746 1.394786 0.985919
H -0.242121 -0.812003 -0.868199
H -2.190230 -1.654227 0.653589
H 5.993465 -2.048552 -0.109729
H -3.918755 -2.605001 1.800158
H -4.904264 0.411193 -1.175015
H -6.345448 -3.083496 2.135368
H -7.335206 -0.055481 -0.822179
H -8.073544 -1.797546 0.831469
H -1.235488 2.586457 0.336402
H 8.435832 -1.566356 -0.715935
H 9.200818 -0.646897 0.617991
H 8.306440 -2.159304 0.969048
H -2.863375 4.475494 -0.425629
H -2.701502 3.678804 -1.921678


