%chk=000261479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261479

0 1
O 2.763905 -1.856439 0.209485
O -2.072624 -2.191837 -0.438169
O 0.406114 -3.465635 -0.387847
N 4.476974 2.153925 -0.301144
C 1.405088 0.014043 0.405713
C 0.141286 0.659103 0.381400
C -1.059773 -0.059199 0.113827
C 2.678742 0.766366 0.676759
C -2.336926 0.649663 0.131448
C 1.483392 -1.367720 0.168443
C 3.249398 1.356270 -0.628596
C -0.929947 -1.447055 -0.168701
C 0.303498 -2.106513 -0.103698
C -2.349405 2.054036 0.325009
C 0.068051 2.090855 0.607904
C -1.108819 2.757460 0.563049
C -3.590409 -0.001695 -0.019965
C -3.573050 2.772581 0.311459
C -4.776114 0.708890 -0.025434
C -4.772418 2.111908 0.132152
C 4.116340 3.518654 0.187249
C 5.369878 2.254623 -1.494543
C 2.984319 -3.272346 -0.015026
C -2.094943 -2.795009 -1.765196
C -0.247803 -4.312439 0.603157
H 2.517645 1.561665 1.431903
H 3.440058 0.091951 1.132367
H 2.471629 1.943054 -1.160543
H 3.526507 0.515690 -1.302816
H 1.001169 2.620065 0.812944
H -1.154753 3.835707 0.717144
H -3.624048 -1.090993 -0.124064
H -3.553890 3.852587 0.448537
H -5.725172 0.189176 -0.146508
H -5.713191 2.657689 0.118645
H 3.496366 3.422954 1.092907
H 3.576386 4.143728 -0.538481
H 5.037035 4.046843 0.482294
H 6.277719 2.813615 -1.216955
H 4.920297 2.740391 -2.372250
H 5.693467 1.241254 -1.782754
H 4.079587 -3.322549 -0.020759
H 2.556277 -3.579821 -0.975785
H 2.555447 -3.850270 0.807168
H -2.146539 -2.002356 -2.516466
H -3.018962 -3.380856 -1.733887
H -1.215240 -3.432910 -1.912749
H -1.315822 -4.069788 0.658834
H 0.234956 -4.185122 1.574775
H -0.082182 -5.313596 0.194761


%chk=000261479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261479

0 1
O 2.801191 -1.883589 0.125665
O -2.036485 -2.308653 -0.549945
O 0.468642 -3.471395 -0.513964
N 4.553317 2.118401 -0.453723
C 1.402985 0.037383 0.382495
C 0.111132 0.667313 0.352220
C -1.103709 -0.091617 0.112240
C 2.681354 0.819200 0.640269
C -2.406928 0.594232 0.153309
C 1.502297 -1.353341 0.150805
C 3.278670 1.396412 -0.672106
C -0.936784 -1.485527 -0.178294
C 0.327460 -2.115178 -0.139353
C -2.436936 2.028011 0.337335
C 0.009897 2.100879 0.538826
C -1.203439 2.754149 0.513939
C -3.670499 -0.077682 0.057857
C -3.683061 2.726069 0.369692
C -4.882398 0.627495 0.103326
C -4.897801 2.042752 0.247956
C 4.379098 3.409847 0.239099
C 5.330240 2.268773 -1.701016
C 3.060418 -3.248257 0.619098
C -2.137005 -2.511093 -2.015867
C -0.213748 -4.455646 0.360538
H 2.498579 1.627393 1.370335
H 3.441622 0.149769 1.072920
H 2.515938 2.045514 -1.177604
H 3.480429 0.546020 -1.348975
H 0.925467 2.678122 0.689200
H -1.251670 3.841862 0.643909
H -3.677675 -1.163813 -0.034453
H -3.669294 3.814639 0.503007
H -5.827619 0.077193 0.032769
H -5.848638 2.586211 0.276052
H 3.911016 3.257955 1.226820
H 3.747813 4.135920 -0.337588
H 5.366903 3.875395 0.406739
H 6.309842 2.728766 -1.475788
H 4.822086 2.904348 -2.471570
H 5.514017 1.274732 -2.145634
H 4.150101 -3.282619 0.776905
H 2.748140 -4.000272 -0.121658
H 2.540339 -3.428390 1.579844
H -2.305702 -1.543430 -2.524394
H -3.004729 -3.171953 -2.167165
H -1.217979 -2.991396 -2.396597
H -1.295205 -4.245942 0.404050
H 0.222542 -4.427860 1.378043
H -0.024731 -5.436503 -0.102567


