%chk=000284233.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284233

0 1
O 5.149020 1.648307 0.463399
N -3.180161 0.147426 0.105269
N -5.032688 -1.527289 -0.072885
N 5.664527 -0.502782 -0.038050
N -5.455162 0.875294 -0.289647
N -3.726940 2.466402 -0.343140
N -7.188483 -0.719441 -0.598707
C -3.587872 -1.350148 0.099822
C -1.771882 0.482486 0.121731
C -2.862192 -2.042863 -1.063713
C -3.181543 -1.939429 1.458645
C 2.417584 1.454956 0.218116
C 0.953333 1.121451 0.184942
C -4.142878 1.132604 -0.170163
C 3.269858 0.187567 0.070092
C -1.086337 0.735650 -1.079221
C -1.103218 0.559981 1.353870
C 0.270897 1.052300 -1.040792
C 0.256615 0.873596 1.377583
C -5.835186 -0.499446 -0.293040
C 4.744610 0.527085 0.185856
C 7.120958 -0.208825 0.079938
C 5.280970 -1.906316 -0.322762
C 7.774623 -0.059766 -1.292537
C 4.998372 -2.692607 0.957808
H -3.191543 -3.089816 -1.133979
H -1.775929 -2.037269 -0.942322
H -3.104733 -1.578030 -2.026529
H -3.575362 -2.962813 1.547725
H -3.606247 -1.367471 2.291379
H -2.096700 -1.984560 1.584544
H 2.682322 2.181068 -0.580640
H 2.692375 1.981199 1.159262
H 3.055512 -0.301601 -0.902134
H 2.991565 -0.551331 0.850621
H -1.617271 0.689018 -2.030690
H -1.642331 0.374782 2.282763
H 0.803947 1.249814 -1.970685
H 0.778395 0.930057 2.332801
H 7.243670 0.739744 0.661530
H 7.609395 -1.017598 0.664462
H 4.391660 -1.924347 -0.992714
H 6.104002 -2.395015 -0.894007
H -4.472303 3.157871 -0.367113
H -2.894252 2.775606 0.139597
H 7.694347 -0.970265 -1.894847
H 7.309258 0.753637 -1.866015
H 8.839212 0.181667 -1.192608
H 5.870305 -2.707587 1.623857
H 4.169607 -2.261464 1.531684
H 4.738692 -3.733305 0.732547
H -7.568819 -1.618857 -0.335876
H -7.814898 0.063273 -0.466924


%chk=000284233-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284233

0 1
O 5.233097 1.727781 -0.037306
N -3.206365 0.107337 -0.046148
N -5.023152 -1.552201 0.288506
N 5.714064 -0.537301 0.142208
N -5.502861 0.834603 -0.041627
N -3.791310 2.404610 -0.226228
N -7.170927 -0.663620 0.597153
C -3.665731 -1.358418 -0.240332
C -1.806656 0.455256 -0.006985
C -3.645251 -1.677416 -1.762392
C -2.712989 -2.296058 0.526256
C 2.453600 1.475085 0.141849
C 0.969640 1.149061 0.092739
C -4.188632 1.087220 -0.112366
C 3.318312 0.191448 0.060093
C -1.074524 0.673827 -1.204096
C -1.144572 0.600299 1.238712
C 0.294516 1.014181 -1.148641
C 0.224124 0.940085 1.283144
C -5.836226 -0.502549 0.264001
C 4.821208 0.524866 0.053227
C 7.167520 -0.235010 0.129767
C 5.316831 -1.959524 0.236986
C 7.751915 -0.202811 -1.298353
C 5.258553 -2.484040 1.690167
H -4.028791 -2.700512 -1.919623
H -2.620655 -1.617454 -2.173341
H -4.300659 -0.975472 -2.308458
H -3.094723 -3.324134 0.413818
H -2.714938 -2.048074 1.601049
H -1.680176 -2.249865 0.139177
H 2.742944 2.142699 -0.688443
H 2.706999 2.013789 1.072354
H 3.059508 -0.364965 -0.864126
H 3.071466 -0.480880 0.904322
H -1.585886 0.582122 -2.168688
H -1.716368 0.446936 2.159999
H 0.846096 1.188795 -2.080925
H 0.721098 1.054275 2.254496
H 7.307592 0.749394 0.607343
H 7.681255 -0.997722 0.744824
H 4.340292 -2.104510 -0.255061
H 6.049043 -2.553858 -0.342729
H -4.525071 3.107292 -0.192540
H -2.816819 2.666237 -0.346671
H 7.603339 -1.166047 -1.820984
H 7.267019 0.594999 -1.885759
H 8.837618 0.003188 -1.264530
H 6.233291 -2.362877 2.196024
H 4.500570 -1.938305 2.279751
H 4.998032 -3.558447 1.702322
H -7.514923 -1.590568 0.828602
H -7.760639 0.159851 0.665565


