%chk=000224839.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224839

0 1
O -2.945714 0.354857 0.850009
O 0.941727 -1.426218 1.977915
O -1.348842 1.134864 -0.553642
O 2.963997 0.599179 1.837817
N 1.152126 0.238712 0.383318
N 3.120663 1.383829 -0.308345
C -1.016348 -0.964605 0.679961
C -1.059006 -1.997155 -0.444762
C 0.445640 -0.747053 1.115079
C -1.729245 0.292604 0.230764
C 2.471469 0.706235 0.738576
C -3.790602 1.497208 0.529649
H -1.551462 -1.384447 1.583569
H -2.092253 -2.279735 -0.689402
H -0.586303 -1.628862 -1.364903
H -0.535718 -2.919859 -0.149497
H 0.658007 0.729497 -0.385815
H -3.267887 2.424513 0.785965
H -4.664074 1.328135 1.169560
H -4.047959 1.474351 -0.533552
H 4.083137 1.657098 -0.154819
H 2.845746 1.291054 -1.270643


%chk=000224839-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224839

0 1
O -2.984804 0.370069 0.766165
O 0.991276 -1.508040 2.107803
O -1.189626 1.176007 -0.462044
O 3.473309 -0.308152 1.025263
N 1.206716 0.157325 0.440285
N 2.931509 1.590201 -0.213334
C -0.985927 -0.955596 0.798426
C -1.073439 -2.066022 -0.299568
C 0.510002 -0.784804 1.203155
C -1.685520 0.299354 0.303216
C 2.613275 0.419974 0.475403
C -3.788831 1.533236 0.301418
H -1.507599 -1.316030 1.699263
H -2.127401 -2.306597 -0.521478
H -0.576197 -1.745782 -1.231616
H -0.574876 -2.976306 0.073060
H 0.612732 0.717005 -0.196248
H -3.330340 2.471348 0.654457
H -4.779720 1.380262 0.749218
H -3.841221 1.541442 -0.799657
H 3.917521 1.834174 -0.271968
H 2.236257 2.241136 -0.574415


