%chk=000202826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202826

0 1
O -1.658376 -0.513914 0.975026
N -5.298390 -0.310433 0.669749
C 0.679258 -0.580727 1.142588
C 1.004741 -0.131564 -0.323209
C 3.102596 0.220076 1.211202
C 1.911110 -0.329453 2.052684
C 2.205064 -0.956832 -0.750977
C 1.474926 1.310275 -0.268802
C 3.341113 -0.769349 0.083242
C 2.613198 1.502370 0.560660
C -0.568172 0.137922 1.672404
C 2.258857 -1.832598 -1.825286
C 0.897513 2.385888 -0.928426
C 4.518298 -1.459061 -0.166788
C 3.162574 2.766128 0.720221
C 3.455184 -2.528868 -2.075976
C 1.458447 3.665239 -0.765142
C 4.568726 -2.344905 -1.258483
C 2.575172 3.852815 0.047491
C -2.956759 0.058701 1.271118
C -3.922294 -0.881095 0.532194
C -6.363110 -1.360794 0.537750
C -5.608361 0.694622 -0.402436
C -6.872817 -1.353071 -0.920685
C -6.393635 -0.020508 -1.525037
H 0.454461 -1.676090 1.114533
H 0.117618 -0.274533 -0.972300
H 3.998327 0.373409 1.842610
H 2.211348 -1.269333 2.547236
H 1.678333 0.386919 2.859180
H -0.572445 1.216411 1.438559
H -0.704648 -0.010042 2.757508
H 1.394796 -1.982746 -2.467852
H 0.027409 2.247935 -1.565539
H 5.393023 -1.321578 0.463376
H 4.034672 2.922430 1.349720
H 3.506089 -3.215893 -2.918444
H 1.013747 4.513056 -1.282574
H -3.129453 0.057176 2.360053
H -2.989405 1.092461 0.889777
H 5.489331 -2.888069 -1.462650
H 3.002216 4.846857 0.164469
H -3.587426 -1.017094 -0.518192
H -3.874622 -1.888575 0.999504
H -7.175403 -1.072365 1.239377
H -6.007164 -2.357927 0.851495
H -4.698169 1.190927 -0.783114
H -6.232439 1.480628 0.073906
H -7.970071 -1.442458 -0.958113
H -6.470434 -2.209859 -1.485641
H -5.755304 -0.193950 -2.406784
H -7.240452 0.594139 -1.869381


%chk=000202826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202826

0 1
O -1.608074 -0.729356 0.909303
N -5.322321 -0.317842 0.736085
C 0.804176 -0.778670 1.199715
C 1.069476 -0.390775 -0.313199
C 3.126596 0.333326 1.145067
C 2.018166 -0.303059 2.069751
C 2.361255 -1.105719 -0.698663
C 1.337318 1.110088 -0.354285
C 3.477396 -0.717767 0.093710
C 2.457765 1.504224 0.429380
C -0.512309 -0.191167 1.723053
C 2.511967 -2.077947 -1.705462
C 0.590665 2.074776 -1.057698
C 4.740627 -1.299192 -0.122862
C 2.830086 2.859756 0.506183
C 3.784498 -2.662552 -1.927206
C 0.968509 3.439344 -0.986894
C 4.893764 -2.275103 -1.139995
C 2.083393 3.830158 -0.208885
C -2.916526 -0.204224 1.316243
C -3.975893 -0.873559 0.430151
C -6.456483 -1.221171 0.392608
C -5.636499 0.934921 -0.016393
C -6.743704 -0.993000 -1.125892
C -6.367858 0.507838 -1.346731
H 0.720844 -1.880507 1.239119
H 0.207672 -0.688753 -0.930869
H 4.002161 0.646422 1.739829
H 2.449989 -1.151276 2.629644
H 1.696671 0.457675 2.806977
H -0.496552 0.920111 1.658022
H -0.660232 -0.474693 2.789916
H 1.651237 -2.379159 -2.314180
H -0.274905 1.769318 -1.657311
H 5.600701 -0.998110 0.487360
H 3.693752 3.162970 1.110201
H 3.910378 -3.415685 -2.713443
H 0.397157 4.194615 -1.538643
H -3.120301 -0.434307 2.383672
H -2.938298 0.901805 1.193505
H 5.875208 -2.728804 -1.319264
H 2.372223 4.886355 -0.161183
H -3.675118 -0.753682 -0.637460
H -3.979606 -1.956730 0.647691
H -7.339163 -0.917220 0.989267
H -6.217057 -2.266682 0.649820
H -4.714968 1.512964 -0.202830
H -6.308098 1.563087 0.598557
H -7.792717 -1.211462 -1.392476
H -6.097669 -1.650128 -1.736305
H -5.715112 0.631310 -2.228456
H -7.265384 1.129934 -1.512443


