%chk=000288178.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288178

0 1
O -5.328983 -1.794843 0.095977
O -4.652264 -0.791392 -1.814690
N 1.822260 0.308251 -0.195225
N 2.836833 0.134003 0.723838
C -1.837786 2.090642 0.745754
C -1.190171 2.072279 -0.653561
C -0.768634 1.813389 1.823825
C -3.011935 1.098196 0.859832
C -0.402731 0.785789 -0.932586
C 0.009125 0.514855 1.567379
C 0.590715 0.515373 0.173934
C -4.232060 1.555819 0.051608
C -5.380576 0.542810 0.119907
C -5.062015 -0.686613 -0.684173
C 4.072196 -0.370299 0.197450
C 4.980192 -0.946551 1.110749
C 4.426756 -0.218929 -1.157941
C -5.130527 -3.096626 -0.514866
C 6.237175 -1.352917 0.659053
C 5.684892 -0.638008 -1.585063
C 6.594811 -1.204478 -0.683543
H -2.235460 3.121725 0.924594
H -0.511526 2.943043 -0.750797
H -1.966830 2.200807 -1.432535
H -1.235895 1.776170 2.825238
H -0.056663 2.663170 1.850380
H -2.687655 0.095141 0.518788
H -3.292981 0.974027 1.923258
H -1.091987 -0.080096 -1.019332
H 0.106924 0.862589 -1.916896
H 0.786776 0.394489 2.345211
H -0.665273 -0.360478 1.674427
H -3.943811 1.719155 -1.009887
H -4.590438 2.535438 0.424362
H -5.608471 0.271418 1.174053
H -6.314530 0.991779 -0.283129
H 2.592015 -0.205315 1.664257
H 4.718123 -1.068016 2.157040
H 3.718801 0.224968 -1.858513
H -5.972516 -3.300194 -1.183034
H -4.184433 -3.120019 -1.066494
H -5.119672 -3.772480 0.346125
H 6.942728 -1.792528 1.363167
H 5.962733 -0.521856 -2.632359
H 7.573669 -1.526084 -1.027479


%chk=000288178-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288178

0 1
O -6.057522 -1.757558 0.000289
O -4.137761 -1.194341 -1.188700
N 1.861975 0.212540 -0.336417
N 2.828979 -0.183635 0.569083
C -1.764673 2.082950 0.804795
C -1.109008 2.179705 -0.601552
C -0.671598 1.717769 1.847114
C -2.962349 1.095750 0.869036
C -0.369246 0.872374 -0.997713
C 0.090892 0.405962 1.491687
C 0.630670 0.460915 0.066676
C -4.154936 1.490519 -0.030722
C -5.359017 0.536547 0.111603
C -5.081145 -0.856137 -0.436926
C 4.148914 -0.423272 0.142321
C 5.116981 -0.829017 1.102919
C 4.532130 -0.269912 -1.218365
C -5.920599 -3.148247 -0.499103
C 6.447011 -1.077031 0.705665
C 5.866274 -0.522471 -1.597449
C 6.834862 -0.926328 -0.646797
H -2.154628 3.089944 1.068580
H -0.378942 3.013868 -0.594104
H -1.863707 2.425478 -1.371853
H -1.125841 1.614991 2.852619
H 0.062567 2.545952 1.902863
H -2.633753 0.076792 0.591288
H -3.311618 1.041496 1.922320
H -1.116682 0.064796 -1.145432
H 0.164992 0.998481 -1.955362
H 0.882949 0.246170 2.249133
H -0.600943 -0.456187 1.581353
H -3.837974 1.502303 -1.089745
H -4.486102 2.517611 0.222210
H -5.679762 0.438497 1.165476
H -6.236173 0.933036 -0.438181
H 2.611700 -0.310381 1.564248
H 4.826978 -0.948725 2.155371
H 3.778438 0.041487 -1.945284
H -5.982077 -3.167768 -1.600214
H -4.952654 -3.573284 -0.184520
H -6.760071 -3.692889 -0.045095
H 7.182096 -1.389010 1.456707
H 6.152826 -0.402638 -2.648994
H 7.868448 -1.119499 -0.952724


