%chk=000273261.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273261

0 1
O 0.574424 2.476394 -1.283182
O 0.804871 3.064523 0.868405
O 2.164495 -2.112619 -0.993343
O -1.721651 -0.413297 1.378236
O 1.980296 -1.967498 1.236694
N -0.511596 0.099244 -0.486128
N -3.877174 -1.546702 -0.024664
C 0.604101 0.667816 0.283208
C 1.953359 0.066348 -0.145210
C 0.670144 2.186539 0.058524
C -1.643842 -0.420361 0.165382
C 2.017410 -1.399485 0.175941
C -2.725209 -0.981914 -0.757792
H 0.423961 0.486456 1.393019
H 2.790074 0.581546 0.383340
H 2.136391 0.234938 -1.233789
H -0.437241 0.156040 -1.499610
H -2.298504 -1.777088 -1.414911
H -3.098252 -0.184452 -1.444143
H -4.301313 -0.837790 0.572278
H -3.572323 -2.298173 0.592665
H 0.594128 3.455579 -1.468364
H 2.232751 -3.094645 -0.840956


%chk=000273261-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273261

0 1
O -0.415138 2.653591 -0.591177
O 1.751059 2.776512 0.233675
O 2.960608 -2.257872 -0.608408
O -1.804609 -0.127392 1.321535
O 1.665976 -1.919258 1.292022
N -0.484715 -0.037600 -0.594529
N -3.974416 -1.370843 -0.101874
C 0.656102 0.563854 0.088989
C 2.002074 -0.074347 -0.321446
C 0.751956 2.091265 -0.075669
C -1.675041 -0.304500 0.076914
C 2.151578 -1.479025 0.229991
C -2.829813 -0.816935 -0.824429
H 0.483178 0.380418 1.171044
H 2.823628 0.545101 0.086931
H 2.133148 -0.092347 -1.417567
H -0.463489 -0.105766 -1.614257
H -2.438084 -1.576850 -1.528321
H -3.172034 0.037055 -1.443037
H -4.386310 -0.692898 0.549848
H -3.746201 -2.237042 0.399221
H -0.317281 3.644559 -0.611991
H 3.087122 -3.158283 -0.201862


