%chk=000145579.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000145579

0 1
O 4.372796 -1.363363 -0.142633
O -4.365302 -1.381605 0.133702
N 1.214627 0.918130 -0.041763
N -1.215839 0.912801 0.044033
N 2.550689 -0.655398 -1.383686
N 3.623030 0.787668 0.250193
N -2.545670 -0.672897 1.378088
N -3.623721 0.774234 -0.248283
C -0.002431 1.791963 0.003697
C 1.241341 0.058342 -1.272681
C 2.482382 1.720485 0.060913
C -1.238517 0.045300 1.269615
C -2.486921 1.710552 -0.053418
C 3.533789 -0.502868 -0.364138
C -3.529547 -0.519069 0.359451
C 2.448129 -2.012386 -1.980385
C 4.249098 0.800230 1.597351
C -2.438507 -2.032194 1.968699
C -4.249057 0.791223 -1.595726
H -0.095391 2.450619 -0.895369
H 0.087768 2.445749 0.906591
H 1.112155 0.643188 -2.217046
H 0.389857 -0.664405 -1.192171
H 2.404923 2.429449 0.916420
H 2.696288 2.310777 -0.866484
H -1.109616 0.624589 2.217434
H -0.385072 -0.674473 1.183332
H -2.412594 2.425116 -0.904526
H -2.703048 2.294181 0.877676
H 2.081295 -1.924098 -3.015251
H 1.788490 -2.687526 -1.413071
H 3.454705 -2.477496 -2.012871
H 4.720694 1.781165 1.766259
H 5.051027 0.033536 1.634332
H 3.537146 0.588242 2.409479
H -3.443597 -2.500601 1.999652
H -2.071369 -1.947349 3.003744
H -1.777081 -2.702754 1.398039
H -4.724537 1.771097 -1.759844
H -5.047845 0.021489 -1.637146
H -3.535768 0.586357 -2.408510


%chk=000145579-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145579

0 1
O 4.492338 -1.459665 0.002833
O -4.484610 -1.476967 -0.010754
N 1.198148 0.904863 0.013445
N -1.199254 0.899996 -0.012065
N 2.447334 -0.881432 -0.982876
N 3.532169 0.615020 0.510434
N -2.440934 -0.896062 0.976144
N -3.532641 0.603865 -0.508609
C -0.002272 1.750150 0.002636
C 1.403143 0.119897 -1.216384
C 2.434064 1.587464 0.415091
C -1.400612 0.108221 1.214043
C -2.438050 1.579893 -0.409536
C 3.542473 -0.624745 -0.151508
C -3.537670 -0.639351 0.146918
C 2.375668 -2.146955 -1.720273
C 4.689532 1.002280 1.322329
C -2.363462 -2.165306 1.706526
C -4.692322 0.991053 -1.317226
H -0.068870 2.417547 -0.893220
H 0.061587 2.413638 0.901589
H 1.680255 0.784660 -2.080005
H 0.451586 -0.381740 -1.461014
H 2.277031 2.054499 1.408250
H 2.719571 2.408628 -0.299231
H -1.679954 0.767714 2.080984
H -0.446974 -0.390807 1.455825
H -2.283543 2.052194 -1.400602
H -2.725988 2.396606 0.308900
H 2.398059 -1.978490 -2.815385
H 1.450732 -2.700106 -1.465904
H 3.251084 -2.751269 -1.437144
H 5.146939 1.940230 0.947657
H 5.429760 0.190210 1.260097
H 4.402653 1.146726 2.383116
H -3.237491 -2.770985 1.422023
H -2.384028 -2.002758 2.802557
H -1.437278 -2.714066 1.447211
H -5.153049 1.925121 -0.936952
H -5.429299 0.175753 -1.258758
H -4.407032 1.142475 -2.377466


