%chk=000189588.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189588

0 1
O 1.047793 0.469296 0.815107
O 0.280429 1.071249 -1.281681
N -0.825452 1.704918 0.692528
C 2.242774 -0.076665 0.300070
C 3.268407 0.773961 -0.153183
C 2.376344 -1.474236 0.373814
C -2.123143 2.007290 0.032030
C -3.038381 0.806935 -0.008332
C 4.482205 0.179797 -0.527574
C 3.608800 -2.027899 -0.006237
C 4.646661 -1.206297 -0.451737
C 3.059016 2.245280 -0.244725
C 1.255937 -2.341029 0.837077
C -2.822512 -0.196214 -0.965149
C -4.096234 0.688698 0.902303
C 0.155646 1.064801 -0.079595
C -3.664379 -1.309546 -1.009812
C -4.937250 -0.427617 0.852497
C -4.722930 -1.426502 -0.101923
H -1.923458 2.380289 -1.004514
H -2.583168 2.858865 0.585023
H 5.299930 0.803488 -0.883332
H 3.750874 -3.105532 0.042354
H 5.596467 -1.651417 -0.746892
H 2.408121 2.484914 -1.105115
H 3.994264 2.802307 -0.376341
H 2.561997 2.640876 0.653712
H 0.831772 -2.915001 -0.000091
H 1.585623 -3.060829 1.598467
H 0.435894 -1.753990 1.278090
H -0.888663 1.438634 1.678694
H -1.993638 -0.104272 -1.672243
H -4.269925 1.462689 1.647319
H -3.496673 -2.086701 -1.754378
H -5.760870 -0.517495 1.558993
H -5.379279 -2.294143 -0.139824


%chk=000189588-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189588

0 1
O 1.237986 0.241846 0.740446
O 0.500213 0.945413 -1.407252
N -0.881711 1.003060 0.497537
C 2.542928 -0.111131 0.255249
C 3.494402 0.911060 0.023375
C 2.825789 -1.491186 0.115948
C -2.080275 1.540831 -0.161105
C -3.303985 0.640699 -0.006844
C 4.796598 0.506691 -0.362595
C 4.141088 -1.850224 -0.268245
C 5.119880 -0.860336 -0.507387
C 3.127555 2.373064 0.176043
C 1.751588 -2.532750 0.359893
C -3.215264 -0.750513 -0.268671
C -4.552802 1.189029 0.374014
C 0.285794 0.759393 -0.186265
C -4.355313 -1.575191 -0.154774
C -5.697364 0.365748 0.485769
C -5.601294 -1.019337 0.222274
H -1.812109 1.657411 -1.227938
H -2.307829 2.551156 0.231783
H 5.557131 1.273830 -0.548981
H 4.391638 -2.911263 -0.382257
H 6.132888 -1.153743 -0.804105
H 2.438282 2.686825 -0.630172
H 4.025060 3.012259 0.128102
H 2.615342 2.561480 1.137182
H 0.942646 -2.452252 -0.391180
H 2.170399 -3.551437 0.299805
H 1.282767 -2.403284 1.351719
H -0.906809 0.775924 1.492544
H -2.251197 -1.182347 -0.562769
H -4.631713 2.263258 0.584447
H -4.275532 -2.648255 -0.362307
H -6.657750 0.802789 0.781391
H -6.486031 -1.659616 0.310724


