%chk=000288848.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288848

0 1
O -0.085192 2.478504 1.275185
N -2.306323 1.604935 -0.502748
C -3.749493 1.269513 -0.293163
C -1.376014 0.696861 0.210719
C -0.883896 -0.429376 -0.766722
C -4.257723 1.617075 1.125491
C -4.556761 2.042211 -1.359483
C -5.754540 1.308104 1.251552
C -6.052834 1.731101 -1.229654
C -6.569436 2.047681 0.180953
C 0.622063 -0.423056 -0.627149
C -0.090417 1.446298 0.653396
C 1.068038 0.656367 0.170707
C -1.525368 -1.755148 -0.451705
C 1.539416 -1.301738 -1.191637
C 2.419677 0.873790 0.403956
C 3.350036 -0.015983 -0.167633
C -2.579194 -2.221665 -1.252021
C -1.097412 -2.520019 0.644532
C 2.905128 -1.090513 -0.955007
C 4.797139 0.185585 0.061998
C -3.195027 -3.441562 -0.958814
C -1.715554 -3.739174 0.932620
C -2.765206 -4.202549 0.132626
C 5.570486 -0.838970 0.630747
C 5.402197 1.403339 -0.287897
C 6.936974 -0.643670 0.846930
C 6.769630 1.590580 -0.071170
C 7.538633 0.569239 0.496186
H -3.876117 0.169033 -0.467113
H -1.825532 0.229363 1.124945
H -1.139160 -0.119296 -1.817621
H -4.075913 2.686358 1.344451
H -3.690199 1.051413 1.886533
H -4.192154 1.773846 -2.369208
H -4.386211 3.130477 -1.257015
H -2.119444 2.583645 -0.243817
H -6.111772 1.591489 2.259400
H -5.921619 0.217181 1.163341
H -6.238031 0.665810 -1.466610
H -6.621356 2.313548 -1.978723
H -7.637200 1.772890 0.262735
H -6.518569 3.138822 0.360790
H 1.206442 -2.138399 -1.803182
H 2.749182 1.712293 1.020092
H -2.920755 -1.633059 -2.102722
H -0.277944 -2.165438 1.268504
H 3.636484 -1.769893 -1.396705
H -4.011987 -3.799476 -1.583491
H -1.378318 -4.329911 1.783002
H -3.245366 -5.152273 0.358863
H 5.103129 -1.781541 0.910221
H 4.805969 2.198616 -0.733104
H 7.534235 -1.438470 1.291081
H 7.237015 2.535322 -0.345154
H 8.603262 0.718489 0.665111


%chk=000288848-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288848

0 1
O -0.012257 2.899140 0.292674
N -2.393309 1.588145 -0.702252
C -3.782427 1.252463 -0.298971
C -1.306356 0.812067 -0.123376
C -0.820721 -0.450573 -0.951524
C -4.136229 1.674305 1.157209
C -4.778125 1.893570 -1.293199
C -5.597056 1.307321 1.515230
C -6.244260 1.543851 -0.941619
C -6.591134 1.941891 0.513326
C 0.680763 -0.481537 -0.661667
C -0.022246 1.659935 0.056135
C 1.135728 0.755459 -0.135468
C -1.578527 -1.735794 -0.657996
C 1.614182 -1.509858 -0.899659
C 2.497847 1.000903 0.132258
C 3.448505 -0.023199 -0.112039
C -2.528947 -2.239373 -1.581962
C -1.380906 -2.437408 0.561251
C 2.979482 -1.271754 -0.627823
C 4.900009 0.189181 0.160623
C -3.267311 -3.410396 -1.298293
C -2.117328 -3.606997 0.849157
C -3.064763 -4.098636 -0.079824
C 5.725606 -0.879799 0.606508
C 5.495390 1.469049 -0.014504
C 7.097845 -0.677766 0.865967
C 6.866922 1.673042 0.246245
C 7.676350 0.600246 0.687258
H -3.888432 0.151059 -0.372361
H -1.550041 0.433446 0.901813
H -0.975394 -0.179428 -2.014474
H -3.996610 2.772278 1.248923
H -3.436571 1.199846 1.874297
H -4.527138 1.562097 -2.318102
H -4.647608 2.997024 -1.269303
H -2.200036 2.599678 -0.639914
H -5.829789 1.632522 2.547854
H -5.711808 0.203368 1.493725
H -6.396511 0.451180 -1.064568
H -6.932107 2.043581 -1.651114
H -7.628019 1.638184 0.756451
H -6.548040 3.046791 0.609237
H 1.291033 -2.475633 -1.302441
H 2.799208 1.964558 0.556544
H -2.690116 -1.706273 -2.527345
H -0.640516 -2.069782 1.282930
H 3.709892 -2.058037 -0.850178
H -3.996432 -3.785442 -2.025454
H -1.952780 -4.136686 1.794496
H -3.635044 -5.007548 0.142355
H 5.285626 -1.868236 0.781912
H 4.887671 2.302512 -0.384636
H 7.712926 -1.513907 1.217067
H 7.305551 2.665882 0.096687
H 8.741452 0.758084 0.889333


