%chk=000185139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185139

0 1
O 3.266379 -0.199378 -0.727027
O -3.672990 0.343345 -1.207632
O -4.330476 -1.194781 1.154775
O 4.817409 -2.585879 0.060268
O 4.290549 2.328603 0.250781
N -0.360233 -0.208182 -0.325787
C 0.948473 -0.033652 -1.023383
C -1.464698 -0.482949 -1.297452
C 2.042257 0.054500 0.047568
C -2.765194 -0.518066 -0.557611
C 4.412634 -0.125111 0.058567
C -4.940299 0.398300 -0.617888
C -5.261294 -0.352435 0.536823
C -3.078317 -1.226840 0.537365
C 5.118465 -1.297101 0.403875
C 4.928381 1.122442 0.481003
C -5.882400 1.228134 -1.213834
C -6.527459 -0.279211 1.105090
C 6.290991 -1.217130 1.188209
C 6.083602 1.200907 1.266453
C 6.749032 0.022085 1.621405
C -7.162826 1.300399 -0.637281
C -7.479343 0.560750 0.500778
C 3.663781 -2.835305 -0.784493
C 3.958920 2.613643 -1.135593
H 0.989254 0.851999 -1.692745
H 1.144909 -0.921068 -1.669248
H -1.275397 -1.477034 -1.771020
H -1.533028 0.258886 -2.130509
H 2.120147 1.049227 0.517919
H 1.947626 -0.726359 0.821661
H -0.581754 0.640088 0.212967
H -2.440860 -1.899395 1.100802
H -5.627227 1.801928 -2.102142
H -6.765567 -0.860378 1.993942
H 6.812508 -2.137524 1.443446
H 6.445293 2.174190 1.588772
H 7.647597 0.079288 2.237970
H -7.911990 1.946441 -1.093648
H -8.476157 0.628032 0.935353
H 3.702764 -2.210518 -1.683647
H 3.786714 -3.898949 -1.018855
H 2.747910 -2.647833 -0.216625
H 3.329750 3.505111 -1.042666
H 4.884036 2.832818 -1.676634
H 3.419428 1.778460 -1.596871


%chk=000185139-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185139

0 1
O 3.272049 -0.280379 -0.730104
O -4.006386 0.316890 -1.303648
O -4.219574 -0.123790 1.578279
O 4.619021 -2.741874 -0.026115
O 4.251470 2.181410 0.398323
N -0.412885 0.219789 -0.403442
C 0.884149 -0.050132 -1.054782
C -1.595127 0.046112 -1.267626
C 1.993979 -0.047818 0.001101
C -2.871982 0.061376 -0.465288
C 4.412160 -0.269660 0.113039
C -5.265878 0.286849 -0.636083
C -5.367974 0.077070 0.762820
C -2.983313 -0.144670 0.868626
C 5.073149 -1.489858 0.429326
C 4.899625 0.950794 0.660804
C -6.420866 0.482040 -1.408727
C -6.626369 0.063568 1.384977
C 6.170766 -1.484459 1.322570
C 5.989191 0.949402 1.557654
C 6.612663 -0.272612 1.895362
C -7.692047 0.470697 -0.784189
C -7.794055 0.262279 0.608996
C 4.487587 -2.913272 -1.489654
C 4.260387 2.609302 -1.019538
H 1.146831 0.679631 -1.858661
H 0.838248 -1.049900 -1.525687
H -1.499996 -0.926633 -1.790961
H -1.694529 0.819281 -2.069034
H 2.054191 0.924938 0.529078
H 1.839159 -0.858252 0.736545
H -0.427361 1.130565 0.075645
H -2.131109 -0.358874 1.508416
H -6.312277 0.640807 -2.485927
H -6.675414 -0.100872 2.465594
H 6.646317 -2.440632 1.560243
H 6.324019 1.904014 1.974160
H 7.455466 -0.278258 2.594502
H -8.592053 0.624113 -1.387934
H -8.774178 0.252782 1.096254
H 5.481031 -2.830667 -1.971869
H 4.092519 -3.931866 -1.623589
H 3.795579 -2.167430 -1.914645
H 3.705427 3.559826 -1.039916
H 5.300526 2.775400 -1.359171
H 3.769164 1.857472 -1.662526


