%chk=000188168.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188168

0 1
O -2.083495 0.792570 -0.440622
O -3.398338 -1.407818 -0.670809
O -1.726793 -2.748095 0.080074
N 2.274169 -0.807692 0.376735
C 2.394362 -0.981099 -1.110215
C 3.261761 -1.677374 1.102172
C 3.812260 -0.601303 -1.566576
C 4.691680 -1.303399 0.677658
C 4.870728 -1.439364 -0.839331
C 0.882294 -1.136790 0.835015
C -0.097035 -0.131234 0.334943
C 0.082227 1.301901 0.223455
C -1.389152 -0.386557 -0.072764
C -1.154517 1.817092 -0.249457
C 1.146549 2.187380 0.464175
C -1.390885 3.185084 -0.488214
C -2.138268 -1.637454 -0.189377
C 0.931821 3.538425 0.234592
C -0.312895 4.028802 -0.231145
C -2.706562 3.675554 -0.981002
C -4.285496 -2.565387 -0.823231
C -4.830466 -2.976755 0.527609
H 1.655490 -0.301520 -1.590238
H 2.150697 -2.012962 -1.442518
H 3.087808 -2.761478 0.929776
H 3.139854 -1.495238 2.191887
H 3.986328 0.474942 -1.366351
H 3.897027 -0.733248 -2.660408
H 5.416470 -1.943000 1.212901
H 4.905449 -0.260187 0.985352
H 4.788785 -2.501069 -1.139634
H 5.884932 -1.113488 -1.134630
H 0.868678 -1.104445 1.953637
H 0.550044 -2.168052 0.551197
H 2.104758 1.794823 0.811104
H 1.735287 4.251879 0.412233
H -0.423187 5.101149 -0.392759
H -2.607823 4.197330 -1.943490
H -3.421460 2.851279 -1.131441
H -3.166918 4.376321 -0.269911
H -5.053405 -2.139172 -1.495172
H -3.725877 -3.375160 -1.323822
H -5.624804 -3.725748 0.429744
H -4.041147 -3.411701 1.159537
H -5.244036 -2.118043 1.073120


%chk=000188168-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188168

0 1
O -2.095301 0.830732 -0.429001
O -3.449167 -1.453154 -0.696235
O -1.701444 -2.763540 0.148489
N 2.287426 -0.854801 0.334970
C 2.438525 -1.023158 -1.134952
C 3.285792 -1.667247 1.077891
C 3.847657 -0.598918 -1.594657
C 4.722369 -1.263806 0.689148
C 4.935347 -1.394523 -0.836814
C 0.903077 -1.151649 0.792206
C -0.101836 -0.136069 0.301506
C 0.091057 1.303206 0.204398
C -1.421391 -0.377042 -0.085314
C -1.146444 1.854417 -0.242724
C 1.183597 2.176353 0.451147
C -1.387984 3.224273 -0.461213
C -2.166618 -1.637187 -0.182367
C 0.977113 3.554277 0.246450
C -0.277804 4.063749 -0.199223
C -2.730258 3.744835 -0.937305
C -4.295897 -2.681605 -0.797068
C -5.010601 -2.955005 0.529557
H 1.672047 -0.405714 -1.637627
H 2.255593 -2.089347 -1.433696
H 3.145431 -2.762736 0.877498
H 3.126306 -1.508671 2.161676
H 3.974252 0.483782 -1.399179
H 3.939397 -0.754116 -2.686844
H 5.443940 -1.896723 1.240873
H 4.892490 -0.213757 0.997671
H 4.874907 -2.464754 -1.124767
H 5.944915 -1.040647 -1.119401
H 0.911255 -1.121629 1.901568
H 0.562740 -2.173128 0.506699
H 2.143963 1.765013 0.772144
H 1.798079 4.256677 0.428342
H -0.393252 5.144389 -0.348697
H -2.627991 4.292095 -1.892463
H -3.444708 2.920277 -1.090305
H -3.167955 4.445297 -0.202267
H -5.002585 -2.437244 -1.605952
H -3.654896 -3.531531 -1.090282
H -5.704584 -3.808008 0.411192
H -4.284548 -3.208865 1.319901
H -5.595113 -2.075100 0.848824


