%chk=000234582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234582

0 1
O 1.245243 0.290635 1.021599
O 0.969410 1.518000 -0.866550
O -0.748527 -1.015857 2.061223
O -4.836643 -0.700507 0.012978
N -2.766277 -0.866593 1.058647
N -3.082880 0.448733 -0.927326
C 3.434437 -0.248620 0.092781
C 4.948456 -0.111156 0.293181
C 2.670218 0.637650 1.068914
C 5.723152 -0.988113 -0.687131
C -0.898671 0.352414 0.063477
C 0.507356 0.791057 -0.008087
C -1.348059 -0.529681 1.137416
C -1.750569 0.806741 -0.912886
C -3.660156 -0.421487 0.078720
H 3.158561 0.018479 -0.948782
H 3.121489 -1.304321 0.223225
H 5.219600 -0.384803 1.332296
H 5.251391 0.947381 0.165435
H 2.890794 0.417015 2.129996
H 2.784671 1.713854 0.855370
H 5.473644 -2.048743 -0.566058
H 5.508063 -0.718437 -1.727907
H 6.804476 -0.886923 -0.539463
H -1.388052 1.475515 -1.717945
H -3.144928 -1.488389 1.791483
H -3.717698 0.790055 -1.658008


%chk=000234582-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000234582

0 1
O 1.261078 0.215549 1.056978
O 0.892898 1.534143 -0.831950
O -0.908744 -1.253541 2.060361
O -5.019301 -0.585738 -0.059970
N -2.917525 -0.873281 0.964868
N -3.138971 0.550985 -0.880454
C 3.516631 -0.347926 0.145452
C 5.029697 -0.027634 0.205870
C 2.707796 0.602201 1.037732
C 5.865104 -0.978502 -0.678096
C -0.950819 0.300941 0.138559
C 0.470452 0.742988 0.057469
C -1.500480 -0.649172 1.132145
C -1.797304 0.844636 -0.813593
C -3.790559 -0.336098 0.017383
H 3.160548 -0.261975 -0.898592
H 3.341495 -1.390607 0.473006
H 5.380208 -0.095218 1.255866
H 5.198284 1.019844 -0.116444
H 3.005044 0.520512 2.095935
H 2.792848 1.647683 0.690195
H 5.738074 -2.030091 -0.359753
H 5.555883 -0.908095 -1.737591
H 6.941910 -0.735735 -0.622897
H -1.390695 1.542659 -1.551724
H -3.334509 -1.524011 1.638964
H -3.740539 0.969383 -1.593120


