%chk=000193039.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193039

0 1
O -5.934703 -2.632759 -0.590978
O -7.140688 1.820397 -0.303491
N 2.632648 0.550090 0.841086
N -0.662725 -1.091604 0.130063
N -3.007157 -1.691005 -0.249950
N -4.892290 1.360213 -0.142508
N -2.521917 0.557983 -0.016744
N -6.542446 -0.414286 -0.438256
C 4.010557 -0.042993 0.775196
C 1.576595 -0.506795 0.950122
C 4.985833 1.052401 0.276158
C 0.329100 0.025099 0.211956
C 4.503465 -0.670556 2.085860
C 2.470070 1.575622 1.910920
C 6.246073 0.447284 -0.275719
C -2.003420 -0.727166 -0.072745
C -4.231071 -0.983389 -0.288158
C -3.899186 0.387936 -0.138675
C 7.414297 0.405180 0.500779
C 6.261996 -0.080565 -1.576943
C -5.570323 -1.482761 -0.451140
C -6.265855 0.974995 -0.294804
C -4.541942 2.792911 0.010212
C 8.582990 -0.157300 -0.019880
C 7.432640 -0.642152 -2.091983
C -7.981073 -0.776306 -0.570216
C 8.595540 -0.682454 -1.315619
H 3.966490 -0.847349 -0.010377
H 1.315948 -0.768890 1.998337
H 1.931318 -1.446617 0.475047
H 5.213994 1.765983 1.091321
H 4.479813 1.660357 -0.506232
H 0.601605 0.418156 -0.792668
H -0.117945 0.881958 0.769898
H 3.823873 -1.448441 2.446192
H 4.611804 0.069537 2.885165
H 5.488283 -1.134674 1.944825
H 2.565420 1.190074 2.937005
H 1.477057 2.044715 1.810539
H 3.216981 2.372924 1.770628
H -0.341421 -1.874005 -0.447880
H -2.938342 -2.692714 -0.276820
H 7.412612 0.812088 1.509580
H 5.361224 -0.048650 -2.186687
H -5.456263 3.415373 -0.039986
H -3.851040 3.104658 -0.793313
H -4.045641 2.963042 0.982114
H 9.486972 -0.185320 0.586332
H 7.439924 -1.048194 -3.102223
H -8.073254 -1.801720 -0.975619
H -8.496215 -0.072568 -1.247834
H -8.478435 -0.739963 0.413779
H 9.506230 -1.118878 -1.719167


%chk=000193039-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193039

0 1
O -6.047183 -2.302329 -0.799849
O -6.155968 1.633356 1.819929
N 2.277940 0.532459 -0.267739
N -0.761118 -1.041444 -1.932031
N -3.086346 -1.543027 -1.384987
N -4.139654 1.111947 0.734892
N -2.135092 0.341369 -0.497037
N -6.081154 -0.311206 0.511959
C 3.579862 0.010827 0.251106
C 1.247674 -0.506162 -0.491673
C 4.708095 1.066229 0.036449
C 0.422160 -0.177301 -1.765092
C 3.535443 -0.490434 1.720704
C 1.736365 1.712019 0.444766
C 6.105700 0.479121 0.171883
C -1.940487 -0.759681 -1.288918
C -4.081751 -0.908455 -0.610801
C -3.459038 0.233443 -0.092252
C 6.893815 0.706062 1.329046
C 6.647550 -0.330511 -0.861910
C -5.437502 -1.277629 -0.353850
C -5.497307 0.857796 1.066879
C -3.469610 2.308663 1.275945
C 8.182862 0.138743 1.455716
C 7.934361 -0.900075 -0.741341
C -7.496871 -0.549697 0.871492
C 8.707700 -0.668515 0.420722
H 3.829912 -0.853924 -0.397158
H 0.541740 -0.603446 0.366022
H 1.744921 -1.486488 -0.621059
H 4.581378 1.893983 0.760118
H 4.561684 1.484822 -0.977679
H 1.063940 -0.273258 -2.658206
H 0.071524 0.866344 -1.712728
H 2.740898 -1.246492 1.860302
H 3.345119 0.341772 2.423653
H 4.499061 -0.952658 1.998548
H 1.468785 1.505387 1.508597
H 0.818575 2.059101 -0.060146
H 2.463300 2.541228 0.421312
H -0.664772 -1.923823 -2.431590
H -3.234448 -2.399440 -1.916239
H 6.494797 1.335153 2.134615
H 6.059405 -0.503758 -1.772517
H -4.197979 2.838420 1.906981
H -3.133939 2.961541 0.452459
H -2.590399 2.013415 1.873307
H 8.776898 0.328807 2.357016
H 8.337281 -1.517095 -1.552822
H -7.811411 -1.469089 0.355721
H -8.117466 0.304885 0.555855
H -7.598883 -0.665300 1.963283
H 9.707630 -1.106750 0.514846


