%chk=000279855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279855

0 1
O 0.513887 -0.770944 0.364602
O 2.992843 1.406330 0.027643
O 3.036466 -0.330884 -1.389165
O -3.196027 -1.823790 -0.546645
O -1.180861 -2.404982 -0.022464
N -2.045491 -1.570413 -0.217121
C 1.876253 -0.512311 0.818605
C -0.383149 0.256671 0.280453
C -1.700830 -0.155561 -0.036749
C 2.391312 -1.902582 1.127315
C -0.086051 1.618264 0.467681
C -2.708669 0.820788 -0.177300
C 2.672361 0.112761 -0.335677
C -1.102183 2.558353 0.330195
C -2.412420 2.164875 0.006998
H 1.857204 0.160244 1.707121
H 2.462524 -2.522160 0.215745
H 1.693127 -2.436653 1.793839
H 3.377330 -1.882324 1.605742
H 0.928833 1.944064 0.703766
H -3.725155 0.493178 -0.432119
H -0.878738 3.618701 0.472882
H -3.193693 2.916328 -0.100102
H 3.529326 1.885346 -0.660046


%chk=000279855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279855

0 1
O 0.483714 -0.839655 0.491526
O 3.488154 1.158758 0.173262
O 2.386198 0.044967 -1.552354
O -3.169497 -1.793889 -1.054814
O -1.631115 -2.503752 0.470404
N -2.201436 -1.578800 -0.220228
C 1.875038 -0.495278 0.829764
C -0.450291 0.182792 0.350807
C -1.778738 -0.171763 -0.033272
C 2.573783 -1.835027 1.099189
C -0.153626 1.558511 0.538465
C -2.761150 0.819149 -0.250339
C 2.559574 0.237117 -0.336704
C -1.147072 2.539568 0.345966
C -2.454229 2.177757 -0.053004
H 1.904409 0.150784 1.727066
H 2.524932 -2.475230 0.203327
H 2.064047 -2.350646 1.929008
H 3.629549 -1.667073 1.372918
H 0.853121 1.874118 0.826890
H -3.755123 0.495449 -0.570977
H -0.892635 3.593076 0.503196
H -3.220764 2.942096 -0.208875
H 3.991356 1.580272 -0.576021


