%chk=000115447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000115447

0 1
O 0.079569 -1.403302 1.252124
O 1.222767 -1.696770 -2.338052
N -4.117308 -1.067133 -0.609464
N -1.229851 -1.296861 -0.614184
C -3.437195 -1.672903 0.592968
C -3.291867 0.179978 -0.795541
C -3.115430 -0.491510 1.551409
C -3.044612 0.744671 0.630038
C -2.135448 -2.304338 0.033911
C -1.969438 -0.308653 -1.455708
C -5.563266 -0.790599 -0.393537
C -0.087480 -0.919992 0.145525
C 1.002096 -0.028590 -0.515467
C 1.134600 -0.305608 -2.043301
C 2.368382 -0.365246 0.087935
C 0.616828 1.412535 -0.205408
C 3.268351 0.642896 0.460445
C 0.540621 2.405764 -1.189823
C 2.755782 -1.710360 0.209443
C 0.354232 1.756469 1.135052
C 4.527732 0.309287 0.969044
C 0.183817 3.714997 -0.844235
C 4.013703 -2.038860 0.718617
C 0.000723 3.061577 1.475050
C 4.902799 -1.029828 1.102954
C -0.090704 4.046027 0.483716
H -4.063138 -2.451219 1.073553
H -3.793244 0.911921 -1.460555
H -2.162913 -0.657541 2.086949
H -3.892728 -0.380945 2.321219
H -3.811486 1.488693 0.895135
H -2.074877 1.261016 0.707167
H -1.589543 -2.834661 0.846675
H -2.391730 -3.051723 -0.750780
H -2.220798 -0.823829 -2.413745
H -1.330595 0.564059 -1.698450
H -5.792642 -0.141350 0.464022
H -6.087993 -1.749810 -0.252500
H -5.976499 -0.325680 -1.303109
H 2.101221 0.085355 -2.423528
H 0.299186 0.136060 -2.615678
H 3.001255 1.694328 0.361103
H 0.768872 2.187233 -2.231308
H 2.072702 -2.502235 -0.101363
H 0.443177 0.992447 1.915105
H 0.367590 -2.150523 -2.147779
H 5.216798 1.099320 1.261117
H 0.126938 4.478808 -1.618877
H 4.301005 -3.084423 0.814771
H -0.198742 3.315744 2.515701
H 5.881284 -1.287040 1.502000
H -0.366902 5.064644 0.749441


%chk=000115447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115447

0 1
O 0.275617 -1.661461 1.280434
O 0.983969 -1.831086 -2.295516
N -4.174593 -1.104403 -0.650948
N -1.293762 -1.162103 -0.353104
C -3.555413 -1.699671 0.580758
C -3.383879 0.162177 -0.762250
C -3.402036 -0.515586 1.601897
C -3.339800 0.753556 0.689063
C -2.174714 -2.250605 0.165937
C -1.967761 -0.209927 -1.280230
C -5.638428 -0.898454 -0.555043
C -0.027923 -1.003977 0.239455
C 1.033327 -0.071332 -0.463917
C 1.068031 -0.397900 -2.009579
C 2.452530 -0.382576 0.095554
C 0.666697 1.403147 -0.187451
C 3.336738 0.653429 0.487964
C 0.788934 2.416541 -1.172511
C 2.931414 -1.719929 0.122632
C 0.273000 1.783504 1.123820
C 4.658580 0.365120 0.900896
C 0.494459 3.765817 -0.865799
C 4.249361 -2.007769 0.532019
C -0.019246 3.128604 1.432748
C 5.122514 -0.967063 0.926281
C 0.084299 4.128089 0.436361
H -4.176291 -2.530369 0.958752
H -3.849602 0.842881 -1.496692
H -2.487180 -0.635299 2.207081
H -4.261415 -0.475961 2.293632
H -4.211726 1.410317 0.856945
H -2.431802 1.353956 0.863584
H -1.653750 -2.715988 1.017382
H -2.325522 -3.001647 -0.633739
H -2.085054 -0.670379 -2.281376
H -1.367750 0.707433 -1.367161
H -5.967090 -0.261551 0.300282
H -6.133270 -1.881028 -0.457904
H -5.999433 -0.430259 -1.488092
H 2.042444 -0.090887 -2.421139
H 0.269182 0.143347 -2.552297
H 3.002794 1.695324 0.482213
H 1.129311 2.170205 -2.183758
H 2.272641 -2.535758 -0.182313
H 0.215338 1.017059 1.905883
H 0.097357 -2.153121 -1.982623
H 5.320314 1.185049 1.203231
H 0.595918 4.532202 -1.642626
H 4.594205 -3.047937 0.546249
H -0.320129 3.398058 2.451448
H 6.145450 -1.192868 1.248615
H -0.141250 5.173377 0.674748


