%chk=000293773.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293773

0 1
O -2.719866 -0.615888 1.310337
O -0.366201 1.637930 2.305711
O 0.413151 -1.913912 2.125075
O -4.816657 2.646515 -0.261431
O -5.543372 0.292716 -4.109803
O 1.799038 -0.127681 1.960827
O 2.941678 -2.367482 0.149055
O 7.184739 0.423302 -1.989886
N -3.986479 0.488086 -0.348232
N -5.182206 1.454752 -2.200650
C -1.054733 1.142602 1.160204
C -1.275889 -0.398840 1.235110
C -2.458637 1.757710 1.225857
C -3.438860 0.595493 1.061051
C -0.722901 -1.076742 2.487915
C -3.858489 -0.708716 -1.076088
C -4.678871 1.614263 -0.893179
C -4.353305 -0.842665 -2.333850
C -5.059192 0.259497 -2.999764
C -4.216366 -2.111772 -3.103655
C 1.622524 -1.322291 1.881419
C 2.631527 -2.415841 1.545372
C 4.028997 -1.577081 -0.250154
C 4.406897 -0.376186 0.345074
C 4.677537 -2.096582 -1.390279
C 5.476912 0.342028 -0.204830
C 5.727760 -1.381720 -1.942421
C 6.122142 -0.164060 -1.337281
C 7.669498 1.690466 -1.484670
H -0.491879 1.424902 0.246387
H -0.939851 -0.918082 0.311631
H -2.605341 2.570272 0.486794
H -2.599090 2.258991 2.211162
H -4.298651 0.582700 1.771428
H -1.435698 -1.823876 2.894094
H -0.422822 -0.358130 3.275941
H 0.605769 1.414998 2.249221
H -3.338215 -1.530128 -0.557229
H -5.681330 2.259929 -2.607897
H -4.731072 -2.945997 -2.606664
H -3.163812 -2.394822 -3.241091
H -4.657035 -2.021021 -4.112353
H 3.530369 -2.323625 2.183527
H 2.181865 -3.429098 1.653867
H 3.876291 0.022310 1.212429
H 4.339811 -3.039359 -1.819444
H 5.780404 1.279249 0.251971
H 6.258098 -1.733838 -2.826182
H 8.484753 1.912205 -2.186499
H 6.885110 2.450331 -1.544726
H 8.051051 1.573884 -0.466500


%chk=000293773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293773

0 1
O -1.970282 -0.754606 0.871309
O -0.123478 1.093235 2.611437
O 1.046479 -2.374191 2.335974
O -4.763362 2.059313 0.754915
O -5.948726 0.885712 -3.611531
O 1.827448 -0.598868 3.635587
O 3.716811 -2.896195 1.626332
O 4.649528 0.472607 -2.797844
N -3.258609 0.734326 -0.496752
N -5.305256 1.433299 -1.435481
C 0.024959 0.583554 1.255422
C -0.503753 -0.876442 1.087810
C -0.955488 1.377307 0.374295
C -2.307100 0.673856 0.630126
C -0.343886 -1.812411 2.293017
C -2.978124 0.059719 -1.688972
C -4.469275 1.451103 -0.309711
C -3.814253 0.056177 -2.779388
C -5.084882 0.794542 -2.691484
C -3.511570 -0.680541 -4.060237
C 2.018493 -1.674260 3.008501
C 3.382107 -2.378443 2.944595
C 3.929921 -1.948885 0.591871
C 3.973256 -0.548949 0.770931
C 4.125890 -2.509478 -0.695170
C 4.211510 0.296626 -0.343012
C 4.362256 -1.673184 -1.795804
C 4.406744 -0.263217 -1.626442
C 4.748207 1.927932 -2.671016
H 1.073313 0.659079 0.902566
H -0.043597 -1.346748 0.193800
H -0.673370 1.304289 -0.691479
H -0.980582 2.435988 0.672091
H -2.830221 1.085770 1.506881
H -0.977710 -2.700443 2.161533
H -0.583031 -1.298362 3.238922
H 0.560592 0.653154 3.195626
H -2.044018 -0.507694 -1.683208
H -6.185726 1.948810 -1.335737
H -4.293201 -1.432385 -4.272505
H -2.534373 -1.190756 -4.011863
H -3.508291 0.014450 -4.919357
H 4.142748 -1.670949 3.323789
H 3.357517 -3.267924 3.596673
H 3.842814 -0.089032 1.755693
H 4.089998 -3.596926 -0.808126
H 4.251377 1.378272 -0.183855
H 4.518472 -2.086428 -2.796553
H 4.954083 2.292233 -3.687976
H 3.799790 2.367595 -2.303632
H 5.576951 2.218061 -1.995859


