%chk=000288339.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288339

0 1
O 0.501259 2.624572 0.222335
O 4.033826 -0.087807 2.330857
O 0.817421 2.914236 -2.001420
O -1.279384 -1.153154 -1.907269
O 4.735518 0.185145 0.195727
N -0.493303 0.159757 -0.247745
N -3.380931 -2.692816 -1.575216
C 0.609817 0.635939 -1.098239
C 1.976312 0.054213 -0.693247
C 2.350217 0.316931 0.765619
C 0.658248 2.170509 -1.068252
C -1.427124 -0.763157 -0.743644
C -2.511068 -1.205437 0.145777
C 3.825161 0.134911 0.988006
C -3.465687 -2.174950 -0.307315
C -2.648263 -0.693134 1.455351
C 0.535642 4.071287 0.453338
C -4.506133 -2.592914 0.587540
C -3.658319 -1.103068 2.304149
C -4.591122 -2.065303 1.856092
C 5.406141 -0.300117 2.791661
C 1.969922 4.553842 0.453251
C -4.326657 -3.689477 -2.107616
C 5.852251 -1.706273 2.450422
H 0.394807 0.329304 -2.173859
H 2.763585 0.463214 -1.368316
H 1.966218 -1.040183 -0.888376
H 2.067750 1.356360 1.069001
H 1.776278 -0.345073 1.449947
H -0.526344 0.519531 0.703561
H -1.934015 0.054116 1.812411
H 0.049282 4.136326 1.443217
H -0.079409 4.563102 -0.321826
H -5.231919 -3.330248 0.258154
H -3.744286 -0.695883 3.306350
H -2.630980 -2.374824 -2.217425
H -5.386129 -2.387269 2.531320
H 5.288481 -0.129992 3.877382
H 6.051733 0.472538 2.337735
H 2.035995 5.613478 0.729407
H 2.594388 3.987239 1.154709
H 2.425105 4.449008 -0.544346
H -4.313765 -4.621200 -1.513764
H -5.361219 -3.301467 -2.125573
H -4.046065 -3.946944 -3.143621
H 5.967265 -1.833189 1.362940
H 5.124050 -2.454570 2.788410
H 6.817253 -1.945007 2.912501


%chk=000288339-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288339

0 1
O 0.035787 3.037407 0.057176
O 4.366252 -0.046302 1.717810
O 1.434782 3.265683 -1.797844
O -0.881408 -1.252816 -1.801727
O 4.021993 -1.428392 -0.132954
N -0.530367 0.523795 -0.377896
N -2.881744 -2.905337 -1.393816
C 0.527880 1.045523 -1.252201
C 1.891627 0.308049 -1.069661
C 2.447334 0.420391 0.361361
C 0.721644 2.550112 -1.062355
C -1.209717 -0.635825 -0.713913
C -2.292095 -1.113765 0.188302
C 3.667243 -0.459918 0.577142
C -3.113088 -2.245894 -0.206171
C -2.551388 -0.489656 1.440687
C 0.186344 4.499285 0.355949
C -4.171023 -2.657398 0.671584
C -3.585669 -0.912652 2.292352
C -4.400412 -2.003005 1.889461
C 5.558266 -0.865985 2.102572
C 1.444619 4.755371 1.188229
C -3.664111 -4.043638 -1.862576
C 5.138809 -2.062365 2.961486
H 0.224164 0.879050 -2.304266
H 2.609425 0.726868 -1.797613
H 1.734477 -0.751349 -1.332067
H 2.715899 1.458748 0.628891
H 1.674686 0.099610 1.089384
H -0.842859 1.130392 0.380310
H -1.919255 0.339725 1.780540
H -0.736509 4.746676 0.904109
H 0.218820 5.043148 -0.604095
H -4.805643 -3.501213 0.385553
H -3.754959 -0.413588 3.251296
H -2.072659 -2.544236 -1.931344
H -5.214533 -2.345520 2.538924
H 6.191256 -0.156764 2.659568
H 6.070465 -1.193939 1.180943
H 1.489684 5.823614 1.470047
H 1.437260 4.155720 2.114852
H 2.352915 4.515664 0.610719
H -3.612695 -4.904361 -1.164266
H -4.733405 -3.785923 -2.006169
H -3.262185 -4.372460 -2.834593
H 4.514722 -2.761506 2.380108
H 4.574184 -1.730993 3.850095
H 6.036988 -2.607930 3.306176


