%chk=000202436.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202436

0 1
O 0.311481 2.969848 -0.828962
O 0.700551 1.302697 -2.245102
N -4.096332 -0.519492 0.024756
C 0.760159 0.873862 0.229514
C 1.786594 1.668245 1.119575
C -0.650686 0.928260 0.877289
C 1.241135 -0.553690 0.008924
C -1.722005 0.196965 0.061530
C 0.616287 1.643671 -1.089672
C 3.142254 1.803252 0.419638
C 1.966675 1.035512 2.500719
C -3.116911 0.415845 0.672971
C 2.043254 -0.900152 -1.089296
C 0.920523 -1.549378 0.948493
C 2.507353 -2.209454 -1.246878
C 1.386050 -2.856486 0.790053
C 2.182679 -3.192209 -0.308671
C -4.414636 -0.090821 -1.369764
C -5.349682 -0.595672 0.835334
H 1.359987 2.697910 1.256708
H -0.938718 1.992339 1.014206
H -0.597864 0.498868 1.898644
H -1.504639 -0.891873 0.015857
H -1.713251 0.533418 -0.993524
H 3.062937 2.321704 -0.541818
H 3.843994 2.378571 1.035175
H 3.606629 0.826237 0.234424
H 1.012700 0.911481 3.024559
H 2.607854 1.659877 3.134094
H 2.442008 0.047954 2.437666
H -3.410367 1.483474 0.587934
H -3.084561 0.179854 1.759391
H 2.299763 -0.157190 -1.848161
H 0.297997 -1.309843 1.810544
H 3.122105 -2.461427 -2.109770
H 1.123452 -3.616318 1.524105
H 0.188559 3.498296 -1.660379
H 2.543041 -4.210759 -0.433512
H -4.873405 0.904278 -1.456892
H -5.094889 -0.828620 -1.824289
H -3.488704 -0.099321 -1.968536
H -5.882921 0.357587 0.959166
H -5.107623 -0.994439 1.833246
H -6.036828 -1.315858 0.362309


%chk=000202436-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202436

0 1
O 0.290519 2.909774 -0.960353
O 0.641700 1.086499 -2.324182
N -4.244054 -0.431643 0.052713
C 0.765519 0.811826 0.181340
C 1.758544 1.664763 1.099361
C -0.669882 0.850870 0.829424
C 1.299128 -0.622780 -0.021571
C -1.794877 0.203044 -0.009058
C 0.597502 1.547219 -1.163386
C 3.127527 1.930278 0.429662
C 1.977213 1.033951 2.494311
C -3.156865 0.338612 0.702480
C 2.290449 -0.915631 -0.997309
C 0.885013 -1.681813 0.829182
C 2.839932 -2.210209 -1.117929
C 1.431869 -2.978901 0.712757
C 2.414765 -3.252339 -0.263746
C -4.553780 0.032293 -1.314987
C -5.454835 -0.480919 0.897307
H 1.256922 2.642419 1.235095
H -0.915849 1.913290 1.017019
H -0.629700 0.360155 1.819087
H -1.590261 -0.869759 -0.177799
H -1.838231 0.680508 -1.006347
H 3.022286 2.417190 -0.557332
H 3.728106 2.604460 1.067849
H 3.700051 0.994812 0.297700
H 1.035472 0.908616 3.057497
H 2.633467 1.691813 3.093848
H 2.467324 0.046988 2.418132
H -3.418404 1.429377 0.789002
H -3.056622 -0.046431 1.737411
H 2.620336 -0.137396 -1.689823
H 0.126406 -1.505797 1.598057
H 3.596930 -2.404308 -1.886280
H 1.085733 -3.773497 1.383553
H 0.144325 3.330638 -1.850634
H 2.837978 -4.258516 -0.360118
H -4.883134 1.103766 -1.350910
H -5.364707 -0.588241 -1.736345
H -3.673280 -0.079670 -1.969110
H -5.922287 0.523917 1.067564
H -5.203665 -0.910738 1.883830
H -6.212581 -1.131487 0.424633


