%chk=000180350.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180350

0 1
O -1.572319 0.149730 -0.316143
O -1.530265 2.379143 0.236084
O 0.701641 -2.653916 -0.933815
O 0.085213 -2.609207 1.239043
N 0.277992 1.355587 -0.820296
C 1.292459 2.401906 -0.465375
C 1.000129 0.068005 -1.066979
C 2.476571 2.033770 -1.391158
C 2.341033 0.525729 -1.694038
C 1.648265 2.364586 1.035007
C 1.189427 -0.680919 0.239433
C 2.449622 1.137579 1.489490
C 1.768152 -0.188522 1.347486
C -0.994919 1.386419 -0.221916
C 0.592004 -2.038779 0.298460
C -2.954268 -0.094788 0.201162
C -3.919372 0.738456 -0.627508
C -3.061315 -1.594585 -0.062890
C -2.982353 0.245932 1.683286
C 0.120564 -3.979228 -1.052942
H 0.862778 3.403562 -0.716774
H 0.394349 -0.545120 -1.784769
H 3.446036 2.271157 -0.926169
H 2.423817 2.620830 -2.325291
H 2.333174 0.343852 -2.782540
H 3.188710 -0.050184 -1.288909
H 0.708385 2.436944 1.625319
H 2.221460 3.278847 1.287293
H 2.738688 1.290589 2.552404
H 3.412256 1.093070 0.929004
H 1.797608 -0.804979 2.257293
H -4.961377 0.528711 -0.368378
H -3.793345 0.554599 -1.700729
H -3.747241 1.815785 -0.466739
H -2.290587 -2.148664 0.496458
H -2.913558 -1.823995 -1.124716
H -4.039221 -1.981010 0.239338
H -2.827461 1.324392 1.848492
H -2.191384 -0.281423 2.231753
H -3.939694 -0.022860 2.140209
H 0.397682 -4.597402 -0.192000
H 0.559361 -4.352483 -1.983842
H -0.966497 -3.877417 -1.124199


%chk=000180350-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180350

0 1
O -1.653782 0.131873 -0.305908
O -1.544610 2.421250 0.325549
O 0.573654 -2.702078 -0.811306
O 1.193378 -2.953793 1.417287
N 0.304325 1.277317 -0.525836
C 1.259135 2.389658 -0.317541
C 1.017734 0.041022 -0.921351
C 2.308877 2.128912 -1.433504
C 2.238462 0.594879 -1.738588
C 1.829078 2.363262 1.125433
C 1.435807 -0.768453 0.313855
C 2.729566 1.149365 1.486016
C 2.150607 -0.248278 1.359501
C -1.010671 1.366266 -0.125421
C 1.070707 -2.213714 0.407575
C -3.123071 -0.025012 0.051848
C -3.972688 0.916154 -0.826099
C -3.374027 -1.502563 -0.298921
C -3.316784 0.236473 1.559322
C 0.179984 -4.128108 -0.807445
H 0.723924 3.343864 -0.459777
H 0.359090 -0.579415 -1.542953
H 3.319734 2.447900 -1.122656
H 2.040356 2.708158 -2.333432
H 2.076207 0.420143 -2.815315
H 3.166008 0.070050 -1.454594
H 0.974887 2.414429 1.826291
H 2.426366 3.284254 1.279479
H 3.078673 1.286508 2.526419
H 3.650136 1.190511 0.861709
H 2.375582 -0.945169 2.179936
H -5.045773 0.723982 -0.641116
H -3.768738 0.732813 -1.896251
H -3.754436 1.970256 -0.593926
H -2.712973 -2.156674 0.296165
H -3.175331 -1.685068 -1.369244
H -4.424254 -1.768670 -0.082177
H -3.103558 1.288588 1.804625
H -2.648501 -0.414389 2.150938
H -4.361023 0.008263 1.842384
H 1.044984 -4.764895 -0.555745
H -0.175203 -4.324540 -1.828920
H -0.619639 -4.301630 -0.067408


