%chk=000209604.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209604

0 1
O -0.694045 -0.986915 0.377341
O -2.514739 -3.028204 -0.139078
N -3.734812 0.311242 -1.112887
C -2.523193 -1.796926 -0.868988
C -3.474080 -0.803696 -0.161243
C 3.814836 0.516884 -1.113982
C -3.680733 1.671180 -0.472786
C -1.093685 -1.248282 -1.002801
C 2.788797 0.239775 -0.029523
C 0.580983 -0.507156 0.604330
C 1.522462 -0.250184 -0.393786
C 0.858968 -0.284688 1.978227
C 3.082093 0.462887 1.319543
C -4.448690 2.665036 -1.355525
C -2.211870 2.086674 -0.323328
C 5.047640 -0.375487 -0.923636
C 4.194176 2.002976 -1.124929
C 2.124300 0.202123 2.307981
C -0.163322 -0.575256 3.025238
H -2.916276 -2.099627 -1.867983
H -2.992735 -0.445104 0.775917
H -4.393767 -1.344382 0.145697
H -4.154750 1.659716 0.545430
H 3.365810 0.271350 -2.111767
H -1.076965 -0.299316 -1.569419
H -0.405861 -1.992881 -1.435727
H -4.634602 0.166318 -1.579464
H 1.292903 -0.422616 -1.439775
H 4.059339 0.841251 1.608742
H -4.340439 3.687566 -0.976953
H -4.068996 2.661472 -2.385519
H -5.519095 2.441639 -1.395251
H -1.640511 1.345821 0.254987
H -2.118851 3.051341 0.182800
H -1.720324 2.169351 -1.299846
H 5.573430 -0.151835 0.011273
H 5.762781 -0.241961 -1.742049
H 4.767828 -1.435025 -0.893373
H 3.306872 2.636695 -1.237257
H 4.874870 2.231070 -1.951822
H 4.693141 2.303918 -0.197026
H 2.373342 0.382752 3.353609
H -2.001354 -2.927181 0.694780
H 0.000168 -1.569400 3.465742
H -0.137276 0.158273 3.840920
H -1.182268 -0.568488 2.609767


%chk=000209604-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209604

0 1
O -0.605361 -1.087743 0.547883
O -2.595816 -2.958735 0.154440
N -3.571993 0.433851 -1.192881
C -2.523868 -1.773081 -0.711448
C -3.472390 -0.660033 -0.201611
C 3.861799 0.494330 -1.177997
C -4.026810 1.760266 -0.685353
C -1.075977 -1.283171 -0.839832
C 2.906326 0.161925 -0.027292
C 0.707530 -0.618226 0.752871
C 1.599201 -0.311838 -0.301598
C 1.088622 -0.463359 2.115767
C 3.295451 0.320756 1.324815
C -4.455283 2.624489 -1.888814
C -2.899065 2.452333 0.112191
C 5.138221 -0.387270 -1.137340
C 4.233254 2.001515 -1.190994
C 2.395361 0.010418 2.369476
C 0.118150 -0.797393 3.230274
H -2.866341 -2.123205 -1.703410
H -3.058606 -0.252709 0.737966
H -4.449290 -1.134426 0.045522
H -4.911029 1.646255 -0.008689
H 3.332974 0.272797 -2.127529
H -1.055888 -0.326037 -1.394484
H -0.443120 -2.044170 -1.336474
H -4.132333 0.144945 -2.007317
H 1.289547 -0.435318 -1.344514
H 4.299491 0.686600 1.568543
H -4.768898 3.629759 -1.556624
H -3.610501 2.737010 -2.593335
H -5.304318 2.167059 -2.432973
H -2.550768 1.831594 0.957212
H -3.252392 3.415521 0.524882
H -2.032898 2.642129 -0.547219
H 5.724207 -0.195224 -0.219435
H 5.788644 -0.169278 -2.005007
H 4.881833 -1.461778 -1.154923
H 3.330464 2.634417 -1.263383
H 4.891574 2.233315 -2.049235
H 4.769824 2.284702 -0.266438
H 2.710717 0.138475 3.412202
H -2.032757 -2.763553 0.949590
H -0.171357 -1.865296 3.206191
H 0.563097 -0.584220 4.217155
H -0.817727 -0.215697 3.135770


