%chk=000188613.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188613

0 1
O -3.668336 -0.646454 -0.110751
O 3.358493 -1.426530 -0.264021
O 3.908060 1.032814 -0.304740
O -2.675645 1.427513 -0.156849
N -1.446778 -0.580743 -0.162789
C -5.067219 -0.111475 -0.084256
C -5.236729 0.714013 1.181304
C -5.843366 -1.425224 -0.051628
C -5.295627 0.685741 -1.358649
C -0.105112 -0.081910 -0.199440
C -2.599276 0.216382 -0.145083
C 2.248480 -0.628419 -0.247493
C 0.929300 -1.056457 -0.212152
C 2.556443 0.775669 -0.270654
C 0.187917 1.278910 -0.221769
C 1.528613 1.705876 -0.257585
C 3.156633 -2.878865 -0.242346
C 4.316861 2.438346 -0.330271
C 4.574986 -3.413131 -0.269079
C 5.830453 2.346976 -0.364099
H -4.610344 1.621524 1.152104
H -6.273584 1.037714 1.316764
H -4.940031 0.153162 2.075262
H -5.579087 -2.023538 0.829671
H -5.620323 -2.042923 -0.930949
H -6.923168 -1.245857 -0.028311
H -5.040278 0.105023 -2.252691
H -6.337836 1.006784 -1.453137
H -4.669102 1.593404 -1.378659
H -1.575594 -1.595758 -0.148501
H 0.682840 -2.111533 -0.194377
H -0.610838 2.026942 -0.211876
H 1.732230 2.773850 -0.274495
H 2.615841 -3.142833 0.682184
H 2.573587 -3.164100 -1.134297
H 3.938339 2.931695 0.581027
H 3.896520 2.910886 -1.234235
H 4.592772 -4.507876 -0.255992
H 5.111057 -3.069710 -1.165757
H 5.152309 -3.048036 0.592763
H 6.292136 3.339427 -0.386789
H 6.213626 1.807359 0.513676
H 6.172978 1.786065 -1.245334


%chk=000188613-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188613

0 1
O -3.638579 -0.664328 -0.111964
O 3.406030 -1.491429 -0.266674
O 4.041512 1.088383 -0.305906
O -2.674977 1.508878 -0.162778
N -1.400519 -0.485778 -0.169547
C -5.075802 -0.165473 -0.082535
C -5.303442 0.667624 1.195294
C -5.868004 -1.484048 -0.044751
C -5.366238 0.632479 -1.369804
C -0.060305 -0.003658 -0.204399
C -2.573227 0.254024 -0.151189
C 2.328721 -0.597384 -0.251612
C 0.973158 -0.982093 -0.218277
C 2.671054 0.793468 -0.272181
C 0.271874 1.367499 -0.224269
C 1.633254 1.748464 -0.257893
C 3.098660 -2.933297 -0.244673
C 4.420609 2.513248 -0.330101
C 4.437064 -3.666681 -0.262325
C 5.945872 2.560222 -0.367819
H -4.711848 1.596130 1.171907
H -6.374263 0.930065 1.276741
H -5.022735 0.084592 2.090474
H -5.605655 -2.069904 0.853102
H -5.648572 -2.094402 -0.937726
H -6.951727 -1.271060 -0.021571
H -5.134729 0.022697 -2.261202
H -6.438648 0.898773 -1.403044
H -4.769867 1.557604 -1.402549
H -1.537501 -1.498229 -0.154744
H 0.706253 -2.044149 -0.202673
H -0.519999 2.117570 -0.213475
H 1.871570 2.815745 -0.272867
H 2.519272 -3.175334 0.671254
H 2.484243 -3.195317 -1.131792
H 4.023840 3.018475 0.575340
H 3.980092 2.999482 -1.225696
H 4.272996 -4.759758 -0.246655
H 5.008084 -3.409122 -1.170307
H 5.042566 -3.388607 0.616791
H 6.293859 3.609261 -0.387590
H 6.371012 2.064574 0.521313
H 6.327242 2.045498 -1.265928


