%chk=000294211.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294211

0 1
O -4.461490 -3.676694 -0.899134
O 0.495576 -1.833761 0.313781
O -3.827090 1.101968 0.229953
O 2.842155 0.798135 1.863466
O 0.337512 1.896957 -1.019377
O 2.478140 2.055897 -1.421475
O 1.451232 3.791502 -0.298817
N -3.442671 -1.130046 -0.193323
N 3.288187 -1.220902 0.728171
N -1.710945 0.310196 0.709661
N 4.459582 0.823380 0.229734
C -4.918109 -1.352344 -0.286376
C -2.692526 -2.360503 0.182834
C 2.477355 -1.911229 1.778261
C 2.749917 -1.547703 -0.627690
C -5.175643 -2.484804 -1.289726
C -3.037727 -3.468981 -0.827216
C 0.985764 -1.574892 1.653187
C 1.258140 -1.197190 -0.736597
C -3.047704 0.155110 0.260041
C 3.444064 0.205739 0.980855
C -1.211574 1.695735 0.851813
C 4.406079 2.291146 0.072103
C -0.940326 2.395818 -0.480553
C 3.780246 2.703865 -1.265441
C 1.418859 2.710373 -0.830901
H -5.407555 -0.405526 -0.618132
H -5.345280 -1.609851 0.707954
H -2.951374 -2.686718 1.214622
H -1.591075 -2.169449 0.162554
H 2.654400 -3.003573 1.665564
H 2.855775 -1.616555 2.783708
H 2.906061 -2.639731 -0.788642
H 3.330370 -1.023985 -1.414388
H -4.878455 -2.205352 -2.315649
H -6.227280 -2.822623 -1.273491
H -2.669411 -4.456522 -0.496099
H -2.656075 -3.235777 -1.836732
H 0.793398 -0.512832 1.904047
H 0.346956 -2.236095 2.263800
H 0.791985 -1.614179 -1.647086
H 1.085203 -0.101551 -0.693723
H -1.005950 -0.377353 0.403309
H 4.930580 0.307777 -0.509186
H -0.286109 1.667350 1.475304
H -1.972269 2.290905 1.421753
H 5.440291 2.699812 0.151546
H 3.825997 2.734286 0.926528
H -1.646004 2.106273 -1.283901
H -0.906780 3.496333 -0.380219
H 3.667837 3.801733 -1.346936
H 4.312264 2.304031 -2.148639


%chk=000294211-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000294211

0 1
O -4.224895 -3.575141 -1.551353
O 0.468671 -1.772706 0.777242
O -3.941402 1.069032 0.195530
O 3.538147 0.903124 1.981130
O 0.154696 1.932888 -0.784367
O 2.232840 1.993566 -1.549954
O 1.447608 3.856903 -0.343248
N -3.554501 -1.226849 -0.027153
N 3.292826 -1.153637 0.866499
N -1.839514 0.244949 0.754854
N 4.370106 0.689491 -0.190589
C -4.939351 -1.437791 -0.495720
C -2.804441 -2.481397 0.181180
C 2.603592 -1.670646 2.075991
C 2.694948 -1.730205 -0.367366
C -4.927749 -2.293960 -1.773024
C -2.843574 -3.324999 -1.111262
C 1.114989 -1.284642 2.026741
C 1.200735 -1.351908 -0.447577
C -3.148446 0.070248 0.304536
C 3.715930 0.194817 0.937989
C -1.406905 1.600226 1.113621
C 4.454276 2.133276 -0.423280
C -1.047359 2.493313 -0.082987
C 3.594510 2.585098 -1.624323
C 1.286334 2.717970 -0.830413
H -5.390714 -0.447829 -0.674606
H -5.525042 -1.956984 0.291616
H -3.280391 -3.060448 1.001245
H -1.754453 -2.298377 0.461705
H 2.722156 -2.769346 2.098194
H 3.070449 -1.231037 2.971438
H 2.813475 -2.828785 -0.326892
H 3.204526 -1.369046 -1.275834
H -4.431634 -1.735334 -2.595961
H -5.949972 -2.572948 -2.077135
H -2.404310 -4.322643 -0.943687
H -2.282103 -2.798912 -1.915566
H 1.029723 -0.181592 2.088554
H 0.540988 -1.752327 2.843239
H 0.697593 -1.884233 -1.272851
H 1.088395 -0.260571 -0.594906
H -1.140996 -0.507836 0.734923
H 4.638926 0.053844 -0.941092
H -0.547238 1.535249 1.804175
H -2.238916 2.104262 1.639276
H 5.500250 2.449266 -0.608564
H 4.117680 2.623544 0.505480
H -1.859387 2.484202 -0.825778
H -0.819671 3.524219 0.241000
H 3.525705 3.687214 -1.654117
H 3.987392 2.203026 -2.581455


