%chk=000271996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271996

0 1
O 3.206410 0.047476 0.423008
O 0.470803 2.168746 -0.203715
O -0.472087 -2.527989 0.333559
O -3.763188 0.518881 -0.488981
N -1.607752 1.326047 -0.339536
N -2.086936 -1.009252 -0.073171
C 0.329144 -0.245152 0.114080
C 1.334931 -0.611071 -1.004623
C 1.031416 -0.264298 1.493727
C 2.629683 0.202538 -0.886939
C 2.343394 0.529633 1.469594
C -0.205446 1.166891 -0.146888
C -0.726517 -1.361697 0.140840
C -2.586492 0.297964 -0.315459
H 0.882890 -0.476342 -2.004156
H 1.584570 -1.694114 -0.914273
H 1.259841 -1.323092 1.758762
H 0.361824 0.119015 2.285101
H 3.427636 -0.190929 -1.542851
H 2.462831 1.278820 -1.086832
H 2.169425 1.614026 1.328175
H 2.951600 0.352943 2.375479
H -1.955074 2.285238 -0.515044
H -2.785407 -1.772483 -0.051956


%chk=000271996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271996

0 1
O 3.268341 -0.031487 0.238995
O 0.315707 2.275727 0.356168
O -0.578803 -2.436247 0.894660
O -3.613281 0.376363 -1.217923
N -1.574005 1.271595 -0.500986
N -2.031152 -1.023279 -0.211567
C 0.279491 -0.193846 0.334011
C 1.161690 -0.552191 -0.944995
C 1.186331 -0.263293 1.603412
C 2.477405 0.245317 -0.966167
C 2.549734 0.439378 1.439897
C -0.302445 1.207145 0.106554
C -0.793931 -1.300316 0.402221
C -2.484795 0.217169 -0.695447
H 0.582945 -0.384189 -1.874278
H 1.401650 -1.629366 -0.875032
H 1.346270 -1.334525 1.816243
H 0.652303 0.176574 2.467053
H 3.104006 -0.086333 -1.810957
H 2.291717 1.335838 -1.061350
H 2.425647 1.536958 1.391998
H 3.209099 0.175644 2.282996
H -1.912857 2.204611 -0.759236
H -2.703570 -1.795448 -0.268371


