%chk=000276285.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276285

0 1
O 0.113389 5.268691 -0.796679
O -4.953391 -2.618663 0.605707
O -4.963685 -0.573429 1.646954
N 1.407813 0.541495 0.316831
N 0.090689 3.056341 -0.302776
N -2.836329 0.788027 0.020026
N -2.733524 3.078662 -0.567147
N -3.020204 -1.502917 0.652593
C 2.123306 -0.728709 0.625605
C 3.567206 -0.350646 0.921816
C 2.037514 -1.792284 -0.460544
C 0.014056 0.594458 0.200597
C -0.626467 1.854707 -0.102433
C -0.803753 -0.511932 0.435214
C 3.938960 -0.070469 2.245021
C 2.289710 -3.124115 -0.093177
C 4.518457 -0.260456 -0.103428
C 1.729184 -1.489059 -1.792022
C -2.046240 1.886548 -0.202743
C -2.215216 -0.362684 0.367508
C 5.256858 0.289518 2.538895
C 2.228038 -4.139582 -1.049586
C 5.835424 0.100210 0.195576
C 1.664451 -2.510278 -2.746301
C 6.206493 0.375105 1.515474
C 1.912884 -3.835098 -2.378523
C -0.556469 4.266646 -0.641728
C -2.042865 4.155761 -0.773197
C -4.390457 -1.418121 1.014508
C -6.369085 -2.823492 0.926788
C -7.233811 -1.958118 0.037415
H 1.648659 -1.149016 1.562084
H 1.956774 1.213948 -0.217745
H -0.378469 -1.484550 0.673171
H 3.202043 -0.125819 3.045957
H 2.543955 -3.369081 0.937568
H 4.239301 -0.483762 -1.133479
H 1.530543 -0.464121 -2.098964
H 1.093892 3.077617 -0.120104
H 5.543568 0.505664 3.567553
H 2.426685 -5.170925 -0.759924
H 6.573942 0.165433 -0.602690
H 1.418585 -2.268723 -3.780052
H 7.233297 0.655667 1.746516
H 1.862439 -4.628107 -3.122996
H -2.683098 -2.405319 0.298403
H -2.560560 5.087404 -1.058685
H -6.515312 -2.613794 2.001239
H -6.463777 -3.904882 0.716346
H -8.298541 -2.184662 0.164416
H -7.095572 -0.887981 0.266840
H -6.985190 -2.088711 -1.023803


%chk=000276285-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276285

0 1
O 0.487146 5.503913 -0.364272
O -4.884828 -2.571641 0.845883
O -5.300187 -0.253573 1.020427
N 1.402584 0.538445 0.135916
N 0.250290 3.186899 -0.093485
N -2.833098 1.141028 0.145508
N -2.542355 3.451355 -0.257788
N -3.143293 -1.183775 0.562526
C 2.084307 -0.720522 0.508007
C 3.548405 -0.378987 0.836958
C 1.943712 -1.846837 -0.530809
C 0.023356 0.720853 0.161474
C -0.542991 2.037477 0.014502
C -0.885851 -0.338647 0.361886
C 3.856004 0.176659 2.105757
C 2.211169 -3.181160 -0.132057
C 4.587196 -0.553638 -0.109835
C 1.573885 -1.592399 -1.871873
C -1.963743 2.185798 -0.024594
C -2.290900 -0.073834 0.363968
C 5.179622 0.549466 2.424921
C 2.118274 -4.241190 -1.059396
C 5.912396 -0.175544 0.206805
C 1.479184 -2.652227 -2.803425
C 6.212370 0.375582 1.473129
C 1.752375 -3.979210 -2.401456
C -0.268631 4.488834 -0.296338
C -1.748188 4.500507 -0.395638
C -4.517432 -1.199850 0.819672
C -6.330428 -2.833808 1.089824
C -7.128223 -2.762223 -0.215580
H 1.610195 -1.074384 1.448814
H 2.008726 1.272075 -0.229947
H -0.522169 -1.363225 0.475555
H 3.055422 0.316041 2.843004
H 2.502431 -3.389018 0.905604
H 4.363533 -0.997336 -1.086225
H 1.345335 -0.567456 -2.184045
H 1.263942 3.149810 0.056619
H 5.406253 0.971929 3.409887
H 2.328433 -5.267412 -0.738225
H 6.708989 -0.315537 -0.532148
H 1.186560 -2.441861 -3.838092
H 7.240481 0.663408 1.718780
H 1.676248 -4.800631 -3.122269
H -2.718522 -2.112359 0.520517
H -2.207650 5.478097 -0.583466
H -6.702668 -2.097269 1.824055
H -6.341840 -3.844654 1.528847
H -8.183019 -3.035852 -0.025795
H -7.107355 -1.739328 -0.627619
H -6.719349 -3.460391 -0.966574


