%chk=000231377.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231377

0 1
O 0.466739 2.118769 -0.090190
O -1.799340 -1.964742 0.812661
O 2.597742 -1.942240 -0.327085
N 1.534944 0.124101 -0.284208
N 0.367238 -1.925706 0.202387
C -0.990719 0.181508 -0.027761
C -1.624472 0.225981 -1.471696
C -1.863698 0.910101 1.022119
C 0.356587 0.912886 -0.106568
C -0.893038 -1.287524 0.383784
C -2.930775 -0.566327 -1.543289
C -1.862004 1.659632 -1.948599
C -1.290708 0.832284 2.432085
C 1.589615 -1.291377 -0.155086
C 2.851664 0.832088 -0.457101
C 3.534814 1.065570 0.883366
H -0.880402 -0.256440 -2.158086
H -2.883488 0.469370 1.003680
H -1.971813 1.974253 0.720418
H -3.380561 -0.491266 -2.540840
H -2.792870 -1.635108 -1.333682
H -3.675632 -0.200848 -0.824712
H -2.129963 1.676872 -3.011957
H -0.977810 2.301844 -1.829238
H -2.679924 2.146214 -1.403617
H -1.233319 -0.199807 2.800437
H -0.289895 1.275761 2.498340
H -1.927009 1.382663 3.138073
H 0.418189 -2.942034 0.383660
H 3.491326 0.209295 -1.125342
H 2.651475 1.800618 -0.972748
H 2.919165 1.678908 1.554116
H 3.755789 0.122256 1.400159
H 4.488753 1.590946 0.747220


%chk=000231377-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231377

0 1
O 0.490239 2.148810 0.289586
O -1.775408 -1.956910 1.065809
O 2.541146 -1.943537 -0.610039
N 1.500306 0.138079 -0.280867
N 0.334967 -1.901906 0.127740
C -0.997589 0.195469 0.126124
C -1.525909 0.210736 -1.405702
C -1.969533 0.925841 1.090237
C 0.368782 0.910056 0.094912
C -0.868438 -1.282242 0.514177
C -2.814196 -0.622968 -1.603584
C -1.743463 1.648270 -1.935386
C -1.514594 0.925871 2.566371
C 1.523752 -1.273942 -0.292766
C 2.789990 0.843245 -0.545636
C 3.636972 1.007372 0.729875
H -0.720244 -0.259472 -2.008043
H -2.956462 0.436807 1.016238
H -2.072419 1.968104 0.744740
H -3.092216 -0.599001 -2.673470
H -2.697569 -1.677884 -1.305428
H -3.659251 -0.201631 -1.031087
H -1.922840 1.605377 -3.025398
H -0.879473 2.308667 -1.753874
H -2.631313 2.114316 -1.472166
H -1.433881 -0.101251 2.963794
H -0.543673 1.438384 2.687252
H -2.252551 1.464545 3.187586
H 0.397674 -2.918590 0.245176
H 3.331377 0.248236 -1.298666
H 2.529817 1.827665 -0.966310
H 3.094197 1.597753 1.487396
H 3.904172 0.024836 1.155671
H 4.574229 1.539395 0.486439


