%chk=000270073.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270073

0 1
O 2.981356 -0.982843 -0.003932
O 3.903516 -0.619843 -2.050469
O 2.557709 3.477716 -0.560110
O 0.183006 4.753435 -0.123224
O 0.697883 0.367264 2.178158
N 2.976624 1.552389 0.605696
N -0.054350 2.115930 0.924014
N -2.004295 0.343051 -0.127472
N -2.627387 -1.999421 1.368936
C 2.342205 -2.300947 -0.311094
C 4.055254 1.099251 -0.301088
C 1.078045 2.982270 1.305869
C 1.294609 -2.062225 -1.389392
C 1.738750 -2.618248 1.052609
C 3.431453 -3.270918 -0.738806
C 3.655817 -0.253957 -0.927178
C 2.265238 2.708639 0.346571
C 5.371127 0.931309 0.452072
C 0.648841 4.465168 1.189596
C -0.137088 0.821414 1.400543
C -1.312447 -0.010057 0.951280
C -3.056942 -0.476749 -0.507358
C -3.371280 -1.655011 0.244249
C -1.626728 -1.201945 1.714943
C -3.835817 -0.143850 -1.662530
C -4.461524 -2.483627 -0.169811
C -4.873711 -0.960818 -2.030604
C -5.187913 -2.135988 -1.280447
H 4.176739 1.846929 -1.141929
H 1.386695 2.758421 2.366333
H 0.729646 -2.973851 -1.610824
H 1.760057 -1.731710 -2.331699
H 0.578259 -1.286519 -1.095647
H 0.928448 -3.349372 0.977506
H 2.485642 -3.010263 1.752276
H 1.331895 -1.703540 1.522150
H 3.039683 -4.286548 -0.858116
H 4.248506 -3.311388 -0.009151
H 3.877851 -2.971491 -1.701061
H 2.663577 0.871198 1.318156
H 5.693628 1.882638 0.897166
H 6.172768 0.596225 -0.220213
H 5.292495 0.199249 1.267276
H -0.225006 4.685835 1.833327
H 1.491963 5.131991 1.450320
H -0.696164 2.493498 0.213697
H 0.943977 4.672573 -0.773295
H -1.021469 -1.456214 2.599721
H -3.578262 0.758683 -2.221350
H -4.686126 -3.377113 0.417030
H -5.480681 -0.726646 -2.906900
H -6.023774 -2.754773 -1.612398


%chk=000270073-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270073

0 1
O 3.427837 -1.204983 0.092669
O 4.398806 -1.023475 -2.041143
O 2.255866 3.445209 -0.561268
O -0.061418 4.629501 0.380815
O 0.491993 -0.262328 1.570685
N 2.679518 1.281014 0.196105
N -0.294821 1.830081 0.897874
N -2.612500 0.745152 -0.001424
N -3.136645 -2.068529 0.311671
C 3.404898 -2.738471 0.172964
C 3.704157 0.995342 -0.825477
C 0.905184 2.563162 1.325926
C 2.493431 -3.268716 -0.950430
C 2.792713 -2.969972 1.564056
C 4.848643 -3.265273 0.073455
C 3.878342 -0.518976 -1.019809
C 2.015034 2.471898 0.236440
C 5.073551 1.642303 -0.480866
C 0.532975 4.038205 1.581158
C -0.421580 0.478893 1.059860
C -1.728634 -0.094785 0.579147
C -3.801102 0.195084 -0.452634
C -4.065324 -1.224945 -0.294259
C -1.992332 -1.500517 0.734359
C -4.775653 1.030919 -1.080489
C -5.298133 -1.765810 -0.769265
C -5.973065 0.473900 -1.536105
C -6.235032 -0.927239 -1.380247
H 3.364887 1.414166 -1.791247
H 1.280088 2.086483 2.251967
H 2.394164 -4.364924 -0.851681
H 2.911673 -3.044477 -1.944723
H 1.485993 -2.823429 -0.870868
H 2.627499 -4.050719 1.723426
H 3.468286 -2.599619 2.354776
H 1.830606 -2.437355 1.653745
H 4.848993 -4.355694 0.255121
H 5.487792 -2.791459 0.839342
H 5.276510 -3.071888 -0.922608
H 2.378585 0.508578 0.812165
H 4.947584 2.735306 -0.413076
H 5.806299 1.416121 -1.274201
H 5.455496 1.260841 0.482226
H -0.237075 4.104518 2.367503
H 1.435563 4.594373 1.904693
H -1.038346 2.349036 0.410292
H 0.664220 4.591023 -0.309799
H -1.243629 -2.137151 1.214096
H -4.552229 2.096735 -1.188157
H -5.473340 -2.837953 -0.638700
H -6.722763 1.109885 -2.018519
H -7.181267 -1.339841 -1.746145


