%chk=000220459.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220459

0 1
O -3.621595 0.616976 0.000617
O 3.964116 -0.137579 -0.000318
N 1.782876 -0.805685 -0.000350
C 0.402510 -0.502549 -0.000121
C -0.004064 0.860488 0.000050
C -0.586256 -1.522482 -0.000034
C -1.374533 1.181780 0.000275
C 1.004712 1.903797 0.000030
C 2.793022 0.206639 -0.000295
C -2.319402 0.156299 0.000345
C -1.932284 -1.201935 0.000199
C 2.316227 1.593853 -0.000107
C 2.227542 -2.221118 -0.000569
C -4.684289 -0.364720 0.000561
H -0.290872 -2.571176 -0.000123
H -1.704446 2.220038 0.000419
H 0.662606 2.941741 0.000141
H -2.678248 -1.993056 0.000285
H 3.107795 2.345537 -0.000097
H 1.876933 -2.747427 0.901525
H 3.339210 -2.261625 -0.001349
H 1.875620 -2.747576 -0.902054
H -4.642545 -0.973841 0.907720
H -4.642694 -0.973591 -0.906772
H -5.576840 0.275911 0.000724


%chk=000220459-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220459

0 1
O -3.682819 0.635693 0.000575
O 4.056126 -0.150550 -0.000564
N 1.794462 -0.810976 -0.000299
C 0.421744 -0.495383 -0.000074
C 0.009063 0.883605 0.000092
C -0.578048 -1.504112 -0.000007
C -1.370045 1.206765 0.000302
C 1.032532 1.908198 0.000034
C 2.827137 0.182440 -0.000264
C -2.348651 0.195616 0.000359
C -1.945268 -1.168239 0.000209
C 2.365333 1.574053 -0.000151
C 2.227040 -2.222046 -0.000556
C -4.732773 -0.384958 0.000591
H -0.299182 -2.560731 -0.000103
H -1.689533 2.254304 0.000424
H 0.723071 2.960015 0.000133
H -2.686164 -1.973232 0.000263
H 3.158083 2.327016 -0.000212
H 1.860548 -2.746318 0.900466
H 3.327617 -2.221724 -0.000783
H 1.860135 -2.746102 -0.901532
H -4.678734 -1.021240 0.906028
H -4.678904 -1.021096 -0.904957
H -5.677673 0.177699 0.000727


