%chk=000209765.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209765

0 1
O -4.862228 0.324977 -0.455907
O 4.567300 -0.716975 0.513236
O 4.982252 2.109177 0.260550
O -3.921730 2.307001 0.076431
N -1.276527 1.025791 -0.105582
N 0.446710 -3.135333 0.061511
C -0.253549 0.109322 -0.307120
C -1.032454 2.441749 0.240037
C -0.843458 -1.124325 -0.685610
C 0.273953 2.913218 -0.417626
C 1.126889 0.554887 -0.130086
C -2.521650 0.403078 -0.333831
C 1.400525 1.939915 -0.193677
C -2.252498 -0.942590 -0.687879
C -0.137533 -2.369068 -1.097879
C 2.165308 -0.351241 0.129272
C 2.713076 2.399763 -0.057974
C -3.265600 -1.964756 -1.019382
C -3.769835 1.129729 -0.203000
C 3.474122 0.103817 0.273780
C 3.758820 1.492184 0.167215
C 0.943080 -4.461897 -0.419652
C -0.537512 -3.325371 1.166035
C -6.186616 0.933468 -0.323593
C 4.287638 -2.109664 0.803162
C 6.144845 1.283009 0.525827
C -6.576807 0.996409 1.138687
H -0.973045 2.534547 1.350616
H -1.900894 3.069277 -0.085854
H 0.530654 3.919851 -0.028846
H 0.127325 3.044112 -1.513290
H -0.822665 -2.993970 -1.716174
H 0.723284 -2.100037 -1.757991
H 1.928324 -1.417133 0.233927
H 2.950817 3.461044 -0.119337
H -3.004490 -2.951265 -0.614635
H -4.262036 -1.697188 -0.622936
H -3.380087 -2.067121 -2.109250
H 1.700957 -4.304252 -1.202465
H 0.166419 -5.128864 -0.822262
H 1.437943 -4.981879 0.415651
H -0.849642 -2.333051 1.537665
H -0.046500 -3.847037 2.001333
H -1.442741 -3.883478 0.888705
H -6.169324 1.929530 -0.801642
H -6.797540 0.223845 -0.909929
H 5.293967 -2.507137 0.976844
H 3.812034 -2.590593 -0.057567
H 3.664391 -2.194477 1.698963
H 6.276569 0.551371 -0.278966
H 6.036136 0.783716 1.494165
H 6.950245 2.025299 0.537235
H -7.622524 1.298651 1.263646
H -6.443067 0.026466 1.633942
H -5.953929 1.724498 1.680806


%chk=000209765-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209765

0 1
O -4.905128 0.334407 -0.518261
O 4.531667 -0.799083 0.822664
O 5.061399 2.001764 0.583174
O -3.947461 2.409459 -0.025867
N -1.299619 1.063616 -0.088801
N 0.473549 -3.140295 0.167846
C -0.275846 0.131736 -0.223638
C -1.020943 2.463364 0.319115
C -0.861795 -1.117083 -0.587752
C 0.284109 2.928184 -0.355500
C 1.110986 0.556427 -0.009269
C -2.542020 0.439446 -0.330561
C 1.415088 1.949861 -0.075143
C -2.279901 -0.926547 -0.649633
C -0.113977 -2.368539 -0.975424
C 2.145095 -0.375763 0.277627
C 2.747217 2.368929 0.099495
C -3.304430 -1.975736 -1.000819
C -3.799373 1.172868 -0.264955
C 3.472108 0.060629 0.470201
C 3.790060 1.450718 0.352930
C 1.204982 -4.325240 -0.330179
C -0.522853 -3.506231 1.198242
C -6.242800 0.991977 -0.455963
C 4.200490 -2.208721 1.047752
C 6.222211 1.386787 -0.092808
C -6.766890 1.034946 0.983154
H -0.916868 2.499293 1.422012
H -1.884221 3.082211 0.037182
H 0.540712 3.938182 0.010749
H 0.111108 3.011793 -1.448295
H -0.789477 -3.025785 -1.575903
H 0.733524 -2.100116 -1.637545
H 1.863128 -1.430340 0.411025
H 3.015653 3.429489 0.045793
H -2.823278 -2.942191 -1.227117
H -4.018382 -2.128796 -0.171986
H -3.911394 -1.672405 -1.871798
H 1.982884 -4.009975 -1.050250
H 0.542412 -5.064483 -0.847540
H 1.698123 -4.842786 0.512181
H -1.025676 -2.596779 1.565408
H -0.010905 -3.991501 2.048639
H -1.306795 -4.208139 0.817360
H -6.159262 2.008511 -0.878647
H -6.871090 0.359886 -1.104886
H 5.144174 -2.678227 1.363503
H 3.831112 -2.687611 0.120951
H 3.436950 -2.318877 1.840771
H 6.084722 1.412772 -1.191471
H 6.371905 0.348308 0.242379
H 7.078398 2.017808 0.190994
H -7.795101 1.442753 0.996167
H -6.790888 0.023025 1.423944
H -6.130292 1.683097 1.608053


