%chk=000197808.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197808

1 1
O -0.542803 -1.489681 -0.185584
O -0.530666 0.190328 -1.758547
N -2.533157 0.547095 0.406370
C -1.037729 0.834560 0.460738
C -2.775339 -0.949858 0.600452
C -0.182655 -0.124213 -0.416744
C -1.934792 -1.781670 -0.377958
C -3.110070 1.011557 -0.911543
C -3.216678 1.301450 1.529071
C 1.291277 0.000726 -0.132192
C 2.006031 1.069702 -0.696637
C 1.942619 -0.938553 0.677504
C 3.370948 1.199035 -0.439001
C 3.311404 -0.803258 0.929232
C 4.024315 0.263577 0.374382
H -0.670423 0.749589 1.513206
H -0.835510 1.885086 0.138982
H -3.858433 -1.183552 0.482461
H -2.502791 -1.231761 1.647931
H -1.988056 -2.867715 -0.145867
H -2.205642 -1.613424 -1.437673
H -3.045343 2.109611 -1.024683
H -2.543085 0.583675 -1.774456
H -4.168783 0.723062 -1.025470
H -3.046909 2.393028 1.451184
H -4.312683 1.145680 1.517013
H -2.851811 0.986229 2.524972
H 0.073789 -0.258244 -2.405959
H 1.500580 1.790494 -1.340568
H 1.386650 -1.780606 1.096874
H 3.933381 2.026971 -0.875046
H 3.824185 -1.535772 1.555882
H 5.094279 0.367050 0.571178


%chk=000197808-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197808

1 1
O -0.558032 -1.580552 -0.171969
O -0.502321 0.148361 -1.847285
N -2.541132 0.545810 0.388190
C -1.009292 0.779669 0.422527
C -2.818995 -0.961130 0.591716
C -0.183171 -0.191472 -0.463816
C -1.996336 -1.820578 -0.373713
C -3.154093 1.049826 -0.923886
C -3.172510 1.321050 1.543728
C 1.302182 -0.034807 -0.155721
C 2.000440 1.074134 -0.701200
C 1.977081 -0.956653 0.681812
C 3.371242 1.252776 -0.414273
C 3.348714 -0.772778 0.961858
C 4.046695 0.330639 0.418293
H -0.693305 0.638779 1.468807
H -0.826210 1.821768 0.116571
H -3.903105 -1.120282 0.462001
H -2.536639 -1.193015 1.632895
H -2.151431 -2.884177 -0.135574
H -2.270412 -1.648566 -1.430368
H -3.031157 2.143205 -0.964127
H -2.620543 0.598978 -1.770180
H -4.224520 0.791975 -0.929808
H -2.930428 2.389377 1.433871
H -4.264500 1.182131 1.512465
H -2.774669 0.944904 2.498461
H 0.166722 -0.275486 -2.445501
H 1.482774 1.783953 -1.357009
H 1.438196 -1.818633 1.084161
H 3.910977 2.104422 -0.840616
H 3.873517 -1.491906 1.598944
H 5.110359 0.468476 0.638251


