%chk=000097455.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000097455

0 1
O 0.759363 -1.849309 -0.507761
O 2.241236 1.924895 -0.312603
O 2.686103 0.043875 0.644447
N 1.912054 0.839302 0.137860
C -2.305344 0.061148 0.005509
C -0.031502 -0.778570 -0.143522
C 0.480420 0.512175 0.098168
C -1.417370 -1.000516 -0.184532
C -1.795950 1.359284 0.236495
C -0.428821 1.580868 0.269803
C -3.778161 -0.156982 -0.038805
C 1.436609 -2.545511 0.575033
H -1.775097 -2.010461 -0.385983
H -2.485008 2.191040 0.379161
H -0.032549 2.591352 0.425301
H -4.055381 -1.217536 -0.119678
H -4.275714 0.236966 0.860606
H -4.228670 0.356554 -0.903643
H 0.693741 -3.023437 1.217200
H 2.087481 -1.858263 1.132050
H 2.031460 -3.283574 0.022093


%chk=000097455-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097455

0 1
O 0.866982 -1.812312 -0.509098
O 2.252132 2.144928 -0.210681
O 2.778422 0.023727 0.432824
N 1.923948 0.929828 0.090742
C -2.305061 0.071673 0.012322
C 0.026841 -0.746213 -0.167940
C 0.490469 0.582805 0.061075
C -1.371433 -0.969547 -0.194586
C -1.810697 1.387781 0.234005
C -0.431145 1.642534 0.243006
C -3.797107 -0.196250 -0.021765
C 1.386027 -2.639609 0.605289
H -1.711791 -1.988837 -0.407053
H -2.514627 2.212422 0.391231
H -0.037019 2.652273 0.388564
H -4.017665 -1.271304 -0.126732
H -4.288692 0.165668 0.900066
H -4.273410 0.330997 -0.869807
H 0.547276 -3.068625 1.187232
H 2.046504 -2.035883 1.249123
H 1.958945 -3.442755 0.119383


