%chk=000185739.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185739

0 1
O -0.197954 -2.151038 0.812478
O -2.658640 -0.964545 -0.023075
N 1.605508 0.124510 -0.252777
C 0.223498 -0.271036 -0.736310
C -0.743627 0.533098 0.122673
C 1.410238 1.171106 0.821401
C -0.081887 1.329908 0.974457
C 0.076753 -1.795609 -0.552028
C -2.224005 0.400189 -0.024108
C 2.470802 0.610959 -1.361083
H 0.060122 -0.028695 -1.815871
H 1.905778 2.135428 0.597084
H 1.874720 0.773043 1.750223
H -0.488377 2.012005 1.700858
H 0.988095 -2.329449 -0.876519
H -0.814500 -2.179668 -1.089057
H -2.578185 0.778624 -1.005384
H -2.769495 0.927096 0.784502
H 3.471382 0.838640 -0.956752
H 2.099389 1.501892 -1.888790
H 2.600877 -0.200829 -2.095901
H 0.488269 -1.756574 1.396948
H -2.147561 -1.487055 0.656730


%chk=000185739-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185739

0 1
O -0.003155 -2.189293 0.468451
O -2.608885 -1.127063 0.532728
N 1.468669 0.207238 -0.154456
C 0.149491 -0.098949 -0.801020
C -0.844522 0.582407 0.148225
C 1.306131 1.417529 0.707391
C -0.184306 1.434434 0.976185
C -0.025804 -1.630771 -0.894170
C -2.319554 0.272612 0.163221
C 2.636578 0.229045 -1.051441
H 0.063801 0.335434 -1.829829
H 1.630871 2.352511 0.185640
H 1.914036 1.332563 1.629585
H -0.646284 2.055683 1.748475
H 0.784084 -2.077527 -1.505325
H -1.002199 -1.901594 -1.325516
H -2.770516 0.433430 -0.837318
H -2.830123 0.947214 0.879606
H 3.560714 0.344824 -0.457942
H 2.597102 1.058194 -1.798755
H 2.711937 -0.725847 -1.600570
H 0.746059 -1.702925 0.920274
H -1.762924 -1.577149 0.836261


