%chk=000209338.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209338

0 1
O 8.864756 -1.085695 -0.433689
O -4.442648 -0.090528 -0.240624
N 6.160153 -0.468132 0.263618
C 4.682960 -0.726438 0.327012
C 3.931643 0.584207 0.034871
C 6.634313 -0.378314 -1.157121
C 6.916287 -1.550226 0.978459
C 2.421347 0.403632 0.219837
C 8.139198 -0.067864 -1.154141
C 8.415368 -1.213300 0.930886
C 1.662778 1.708541 -0.071239
C 0.183048 1.516061 0.118885
C -0.405117 1.745469 1.372891
C -0.620202 1.094711 -0.951924
C -2.576577 1.147659 0.478502
C -1.776469 1.558899 1.554350
C -1.992895 0.914739 -0.774518
C -4.057417 0.982667 0.674951
C -5.771335 -0.446508 -0.291070
C -6.802312 0.143364 0.449326
C -6.012390 -1.502444 -1.196813
C -8.104709 -0.341041 0.272026
C -7.315886 -1.959958 -1.349627
C -8.366411 -1.382771 -0.617988
H 4.349179 -1.527113 -0.366583
H 4.428970 -1.071729 1.353582
H 4.153848 0.931708 -0.992241
H 4.312994 1.381314 0.705278
H 6.442985 -1.306643 -1.737232
H 6.080574 0.443871 -1.658867
H 6.744336 -2.559009 0.545860
H 6.573196 -1.577779 2.034499
H 2.045953 -0.400005 -0.443786
H 2.199092 0.068656 1.252300
H 8.581994 -0.130352 -2.163032
H 8.353386 0.915019 -0.698554
H 8.640437 -0.276839 1.471349
H 9.041847 -2.038564 1.310890
H 2.037321 2.518730 0.587258
H 1.879844 2.051475 -1.103275
H 0.211026 2.066142 2.211008
H -0.173177 0.905503 -1.926223
H -2.218365 1.733958 2.533549
H -2.619577 0.580324 -1.603899
H -4.608454 1.899335 0.391469
H -4.322082 0.672231 1.701672
H -6.618024 0.953010 1.144730
H -5.181804 -1.933743 -1.749170
H -8.920388 0.106342 0.840115
H -7.524976 -2.774461 -2.043304
H -9.380622 -1.750210 -0.747351


%chk=000209338-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209338

0 1
O 9.055639 -1.102996 -0.416914
O -4.568984 -0.235427 -0.309702
N 6.308554 -0.439430 0.295392
C 4.839062 -0.635589 0.380709
C 4.030079 0.627444 0.020844
C 6.800150 -0.311126 -1.101724
C 7.054566 -1.520827 0.992396
C 2.511730 0.419084 0.214028
C 8.312747 -0.036208 -1.107884
C 8.562481 -1.225145 0.965461
C 1.686853 1.690461 -0.131992
C 0.190964 1.483509 0.049795
C -0.423716 1.670974 1.314279
C -0.623794 1.047278 -1.026692
C -2.608648 1.001256 0.412960
C -1.802267 1.427667 1.496214
C -2.004532 0.811670 -0.853337
C -4.099032 0.811000 0.613404
C -5.947028 -0.511373 -0.330476
C -6.905369 0.116511 0.504636
C -6.350755 -1.497289 -1.265832
C -8.267478 -0.249604 0.390077
C -7.710269 -1.850303 -1.366367
C -8.679347 -1.228355 -0.539771
H 4.500134 -1.490256 -0.262614
H 4.604555 -0.914041 1.427204
H 4.219154 0.922708 -1.030728
H 4.384965 1.462735 0.655913
H 6.593723 -1.242268 -1.690248
H 6.282617 0.528116 -1.600624
H 6.871723 -2.519663 0.519386
H 6.709794 -1.573282 2.042878
H 2.160660 -0.421389 -0.418431
H 2.301787 0.127894 1.263247
H 8.709484 -0.020386 -2.136648
H 8.512938 0.939528 -0.614338
H 8.765371 -0.283027 1.519386
H 9.139630 -2.051370 1.412884
H 2.038096 2.523022 0.509213
H 1.905044 1.978606 -1.179247
H 0.183477 2.007029 2.164201
H -0.170531 0.894996 -2.014400
H -2.251247 1.572084 2.487376
H -2.620321 0.466625 -1.689463
H -4.649767 1.751949 0.394702
H -4.317624 0.518863 1.661217
H -6.612403 0.874616 1.236917
H -5.588253 -1.967731 -1.894456
H -9.006527 0.237442 1.036485
H -8.015473 -2.612959 -2.091571
H -9.735617 -1.505122 -0.620843


