%chk=000183385.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183385

0 1
O 1.814049 0.388774 -0.075461
O -3.944082 -2.146170 -0.459968
O 0.744082 -1.432017 -0.976845
N -0.311236 0.633134 -0.809021
C -1.705429 0.198056 -1.116132
C -0.320856 2.021914 -0.250267
C -2.485407 -0.363620 0.106980
C -2.334308 1.525285 -1.617181
C -1.541490 2.669084 -0.950365
C -0.416512 2.010043 1.287045
C -1.809782 -0.148216 1.469500
C -1.675610 1.335929 1.844919
C -2.819203 -1.845308 -0.121181
C 0.736647 -0.260003 -0.631096
C -1.746737 -2.862979 0.072765
C 3.144294 -0.288302 -0.005623
C 3.579201 -0.647022 -1.418186
C 3.976772 0.836039 0.607529
C 3.016790 -1.498189 0.908474
H -1.664854 -0.567992 -1.930609
H 0.635231 2.520910 -0.551682
H -3.476769 0.168460 0.142275
H -3.409169 1.583932 -1.379944
H -2.255371 1.587999 -2.717273
H -1.210794 3.403834 -1.703552
H -2.170026 3.220519 -0.231620
H -0.361392 3.051055 1.659031
H 0.488186 1.500378 1.684847
H -0.816562 -0.637746 1.494010
H -2.413345 -0.660536 2.246963
H -2.576242 1.889489 1.513097
H -1.662108 1.425327 2.950124
H -2.070699 -3.858430 -0.262805
H -0.827119 -2.610189 -0.496641
H -1.442586 -2.953503 1.121894
H 3.535510 0.219055 -2.088553
H 4.600905 -1.038543 -1.440270
H 2.921309 -1.419048 -1.851961
H 3.577868 1.142664 1.582186
H 3.973324 1.727985 -0.031538
H 5.016843 0.524869 0.749165
H 2.348941 -2.256546 0.466111
H 3.985789 -1.976683 1.081766
H 2.594446 -1.228689 1.882395


%chk=000183385-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183385

0 1
O 1.919723 0.480642 -0.159263
O -4.234241 -1.956822 -0.600058
O 0.780145 -1.443165 -0.959861
N -0.309793 0.597667 -0.627962
C -1.637723 0.142702 -1.084298
C -0.375578 2.004495 -0.140856
C -2.573577 -0.327501 0.111825
C -2.163977 1.426820 -1.777107
C -1.624463 2.585983 -0.885325
C -0.491951 2.023867 1.404972
C -1.926608 -0.183983 1.519784
C -1.727124 1.286124 1.983903
C -3.063447 -1.761462 -0.168723
C 0.791788 -0.223483 -0.611031
C -2.090238 -2.908276 0.057922
C 3.273023 -0.214284 -0.080233
C 3.697384 -0.680229 -1.487302
C 4.178527 0.918915 0.434033
C 3.195718 -1.376544 0.930335
H -1.495880 -0.684660 -1.799957
H 0.553357 2.522559 -0.433843
H -3.484455 0.302371 0.091578
H -3.262367 1.431184 -1.874404
H -1.729670 1.493317 -2.790992
H -1.353928 3.467538 -1.490200
H -2.385978 2.910401 -0.154492
H -0.508314 3.079174 1.745634
H 0.431711 1.569823 1.812727
H -0.963988 -0.728427 1.557882
H -2.600279 -0.680583 2.247086
H -2.653675 1.854272 1.761396
H -1.629533 1.295280 3.087613
H -2.511441 -3.841794 -0.346193
H -1.106427 -2.691730 -0.400587
H -1.911754 -3.038645 1.143226
H 3.683945 0.168471 -2.194272
H 4.727722 -1.079174 -1.447622
H 3.024467 -1.468339 -1.859093
H 3.829707 1.281085 1.416782
H 4.177656 1.767768 -0.271472
H 5.214797 0.551686 0.541819
H 2.513389 -2.162390 0.570861
H 4.201951 -1.813682 1.066851
H 2.843898 -1.011966 1.912220


