%chk=000287739.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287739

0 1
O -1.623172 0.080675 -0.139562
N -3.708030 1.968421 1.345906
N 0.180777 -1.503531 -0.446265
N 1.545668 -1.510659 -0.426302
C -5.112551 2.491978 1.440196
C -3.025609 2.853039 0.341524
C -5.452100 3.210366 0.115692
C -4.103662 3.456225 -0.585594
C -3.675267 0.528425 0.932513
C 0.815813 0.604422 0.128879
C 0.716353 2.034806 0.509474
C -2.276119 -0.034753 1.184217
C 2.055892 2.730902 0.770179
C 1.958459 -0.247596 -0.078958
C -0.296419 -0.209436 -0.122283
C 2.975196 1.913835 1.690596
C 3.391413 0.042815 0.023487
C 3.895129 1.045216 0.879274
C 4.291755 -0.721224 -0.744344
C 5.281060 1.252799 0.959366
C -0.560551 -2.682536 -0.810590
C 5.666838 -0.503291 -0.658038
C 6.163156 0.483547 0.199039
C -1.876256 -2.552703 -1.288455
C 0.036999 -3.949931 -0.678750
C -2.594201 -3.702838 -1.621358
C -0.697873 -5.085255 -1.021877
C -2.011696 -4.967223 -1.489058
H -5.119500 3.210045 2.288888
H -5.841063 1.699933 1.685266
H -2.247777 2.302816 -0.226756
H -2.510585 3.648642 0.919035
H -5.987787 4.154750 0.302722
H -6.116877 2.594499 -0.511696
H -4.081813 2.979012 -1.579370
H -3.925860 4.530452 -0.753105
H -3.953263 0.367811 -0.134834
H -4.410212 -0.037273 1.546454
H 0.172067 2.583485 -0.292778
H 0.071893 2.121233 1.413939
H -2.286024 -1.103096 1.451691
H -1.695320 0.547116 1.920175
H 1.866807 3.725469 1.217540
H 2.569517 2.927512 -0.193273
H 2.374604 1.282188 2.379222
H 3.550125 2.595326 2.347659
H 3.906786 -1.496393 -1.411106
H 5.673583 2.023351 1.620241
H 6.350235 -1.101929 -1.256370
H 7.235612 0.653888 0.271921
H -2.327829 -1.563692 -1.403052
H 1.065444 -4.038831 -0.320661
H -3.614344 -3.610022 -1.992582
H -0.241504 -6.070269 -0.924291
H -2.577413 -5.858520 -1.752984


%chk=000287739-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287739

0 1
O -1.620469 0.126708 -0.105465
N -3.540644 2.206309 1.177838
N 0.195183 -1.472250 -0.517324
N 1.584074 -1.520425 -0.437076
C -4.772328 2.908225 1.642043
C -3.256674 2.857615 -0.140326
C -5.670862 3.119657 0.377060
C -4.648678 3.152535 -0.807439
C -3.669592 0.728640 1.113075
C 0.828440 0.562752 0.263716
C 0.711113 1.993265 0.737915
C -2.325005 0.008806 1.215938
C 2.041818 2.769169 0.785870
C 1.973695 -0.285851 0.035248
C -0.276946 -0.222967 -0.094400
C 3.111978 2.065515 1.667035
C 3.428221 -0.035828 0.176806
C 3.974768 1.049786 0.929815
C 4.319317 -0.943328 -0.467135
C 5.385050 1.188731 0.997986
C -0.518370 -2.632315 -0.962179
C 5.715245 -0.793091 -0.379871
C 6.258156 0.284020 0.358252
C -1.859437 -2.539165 -1.415450
C 0.149640 -3.883002 -0.960232
C -2.527796 -3.705861 -1.845313
C -0.530868 -5.036576 -1.399248
C -1.873558 -4.958710 -1.839528
H -4.473213 3.891972 2.053259
H -5.269515 2.343497 2.449444
H -2.605215 2.214313 -0.750487
H -2.724717 3.808771 0.053557
H -6.264513 4.048146 0.446605
H -6.380272 2.280354 0.259557
H -4.895997 2.387482 -1.564610
H -4.642591 4.130449 -1.320263
H -4.197175 0.362290 0.199130
H -4.269841 0.402149 1.984113
H -0.013702 2.525000 0.090475
H 0.264465 2.011995 1.754569
H -2.467123 -1.070079 1.426778
H -1.700859 0.474399 1.999739
H 1.835591 3.775441 1.198432
H 2.443252 2.916371 -0.234729
H 2.594609 1.577987 2.519971
H 3.779930 2.828181 2.108345
H 3.885058 -1.767673 -1.040539
H 5.800687 2.026324 1.571906
H 6.375080 -1.504672 -0.888656
H 7.343106 0.419586 0.430905
H -2.358910 -1.568098 -1.442014
H 1.187494 -3.923970 -0.621579
H -3.562516 -3.629417 -2.198032
H -0.009891 -6.000419 -1.394986
H -2.398191 -5.858747 -2.177697


