%chk=000279595.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279595

0 1
O -3.696415 1.921459 1.817404
O 5.233047 2.297974 -0.567243
N -4.817463 -0.268611 -0.644212
N 0.692334 0.565831 -0.826947
N 1.621203 -1.793142 0.524468
C -4.159480 1.058213 -0.876584
C -4.591034 -1.196204 -1.801364
C -6.272047 -0.115990 -0.310966
C -2.812011 0.999765 -0.202605
C -1.675375 0.674263 -0.835559
C -4.842494 -2.640606 -1.366176
C -6.419338 0.347220 1.137845
C -2.805906 1.308037 1.270846
C -0.383126 0.569500 -0.109393
C -1.594495 0.848057 2.015597
C -0.469600 0.513108 1.377199
C 2.028108 0.445368 -0.372694
C 2.523415 -0.779264 0.221488
C 3.920484 -0.909300 0.474975
C 2.900775 1.488634 -0.637688
C 4.800336 0.160790 0.190971
C 4.282389 1.330286 -0.348920
C 4.380128 -2.153334 1.031928
C 3.482710 -3.147600 1.307398
C 2.086981 -2.921026 1.041632
C 4.815133 3.552813 -1.158999
H -4.058936 1.325015 -1.949909
H -4.759406 1.879331 -0.409852
H -5.218444 -0.946255 -2.683778
H -3.528919 -1.097770 -2.121425
H -6.798815 0.582274 -0.996128
H -6.765376 -1.107213 -0.429913
H -1.635691 0.461255 -1.907489
H -4.281969 -2.873506 -0.449439
H -5.900015 -2.827427 -1.148080
H -4.526488 -3.345388 -2.141624
H -6.010921 -0.398141 1.832514
H -5.861942 1.276656 1.335460
H -7.467277 0.519110 1.396828
H -1.699034 0.820870 3.101353
H 0.427330 0.172854 1.902286
H 2.528260 2.407217 -1.085264
H 5.865501 0.072975 0.388611
H 5.446421 -2.276605 1.221332
H 3.792677 -4.103742 1.723470
H 1.356095 -3.705840 1.271471
H 5.767890 4.095949 -1.220153
H 4.111739 4.068709 -0.499412
H 4.396560 3.383529 -2.155463


%chk=000279595-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279595

0 1
O -3.907399 1.163014 2.354897
O 5.442531 1.994572 -0.987483
N -4.807139 -0.195796 -0.647542
N 0.667227 0.990960 -0.706687
N 1.318965 -1.469278 0.686621
C -4.244558 1.173817 -0.526639
C -4.254653 -0.976324 -1.777660
C -6.282212 -0.257675 -0.478613
C -2.889112 1.109504 0.149918
C -1.705600 1.128918 -0.552022
C -4.342599 -2.499827 -1.565207
C -6.714031 -0.259936 1.001181
C -2.854125 1.024706 1.642326
C -0.399705 0.939702 0.086653
C -1.529194 0.846252 2.281619
C -0.369967 0.793174 1.553846
C 1.976115 0.646265 -0.361608
C 2.326005 -0.606399 0.300041
C 3.732261 -0.922752 0.484648
C 3.011743 1.488609 -0.825364
C 4.742423 -0.018645 0.056293
C 4.379574 1.173810 -0.591649
C 4.040399 -2.171140 1.128022
C 3.009867 -3.019619 1.530122
C 1.654286 -2.630527 1.277733
C 5.127459 3.245371 -1.685852
H -4.162375 1.679945 -1.518572
H -4.928214 1.768180 0.104022
H -4.748106 -0.697648 -2.744205
H -3.187971 -0.704859 -1.880861
H -6.773395 0.591749 -1.014442
H -6.644263 -1.182222 -0.963749
H -1.690294 1.262746 -1.640006
H -3.808787 -2.782674 -0.641562
H -5.387244 -2.849232 -1.477797
H -3.882184 -3.031890 -2.418511
H -6.360204 -1.179219 1.499626
H -6.276467 0.592643 1.548258
H -7.816559 -0.210345 1.084103
H -1.529533 0.781378 3.375345
H 0.601207 0.685850 2.045028
H 2.716808 2.392884 -1.363554
H 5.802130 -0.239463 0.217965
H 5.089978 -2.442925 1.288706
H 3.216916 -3.975956 2.020237
H 0.825439 -3.289767 1.560610
H 6.102996 3.712137 -1.884787
H 4.514485 3.916078 -1.053688
H 4.604577 3.051949 -2.641965


