%chk=000267107.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267107

0 1
O -2.462241 -2.944184 0.362147
O -1.195282 -2.144987 -1.297737
N -1.267551 2.408113 0.248408
C -3.231021 1.111241 1.270272
C -1.819261 1.199803 0.724190
C -0.861955 0.191939 0.601660
C 0.325294 0.775792 0.021921
C 3.883614 0.540767 -1.326359
C 0.048304 2.166070 -0.186607
C 2.534659 1.119390 -0.888103
C 1.580912 0.264008 -0.345589
C -4.062727 0.152266 0.413725
C -3.953470 2.473772 1.242046
C -3.117926 0.632601 2.731346
C -0.994315 -1.229469 0.997729
C 1.004585 3.035087 -0.743158
C 2.232148 2.495163 -1.086566
C 4.400491 -0.441046 -0.269438
C 3.642622 -0.128488 -2.693796
C 4.977044 1.617770 -1.480136
C -3.806010 0.027367 -0.960709
C -5.125587 -0.570354 0.975481
C 4.384014 -0.054886 1.083535
C 4.929898 -1.692551 -0.608078
C -1.501338 -2.081239 -0.133549
C -4.586017 -0.818961 -1.752842
C -5.905428 -1.415820 0.180838
C -5.637667 -1.544322 -1.184878
C 4.878348 -0.906247 2.072031
C 5.424346 -2.546366 0.384856
C 5.400320 -2.157924 1.725661
H -1.735687 3.292395 0.218169
H 1.788662 -0.796850 -0.207486
H -4.973531 2.374799 1.637256
H -3.445766 3.221273 1.859022
H -4.055576 2.860477 0.221947
H -4.086840 0.640837 3.241019
H -2.724157 -0.395676 2.780892
H -2.437927 1.272042 3.305843
H -1.678848 -1.328290 1.882029
H -0.010442 -1.634379 1.333368
H 0.782323 4.084801 -0.899936
H 2.985660 3.145982 -1.530070
H 4.569907 -0.506880 -3.134268
H 2.936630 -0.964191 -2.612800
H 3.208848 0.584681 -3.404901
H 5.945852 1.157522 -1.708199
H 4.749793 2.314951 -2.292929
H 5.102943 2.198179 -0.559541
H -2.985098 0.579112 -1.421877
H -5.351579 -0.481951 2.036788
H 3.974519 0.916034 1.362463
H 4.964893 -2.017269 -1.646564
H -4.367820 -0.914601 -2.815949
H -6.723773 -1.975826 0.629803
H -6.244900 -2.201956 -1.802557
H 4.858183 -0.595993 3.114982
H 5.829762 -3.517458 0.106719
H 5.784954 -2.821672 2.496007
H -2.872384 -3.511397 -0.339932


%chk=000267107-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267107

0 1
O -1.301800 -3.456558 -0.281506
O -1.207092 -1.691126 -1.783424
N -1.259481 2.468329 0.331658
C -3.312246 1.227684 1.222483
C -1.888850 1.249901 0.656815
C -0.965605 0.212707 0.460411
C 0.269178 0.814185 -0.009706
C 3.908450 0.533980 -1.277992
C 0.055907 2.232537 -0.081149
C 2.564016 1.152093 -0.806369
C 1.531068 0.288192 -0.376107
C -4.172875 0.143154 0.523768
C -4.033037 2.593857 0.980737
C -3.208170 1.011026 2.764293
C -1.173858 -1.259463 0.681950
C 1.069441 3.115140 -0.502962
C 2.315535 2.558657 -0.862487
C 4.415265 -0.493961 -0.233546
C 3.658270 -0.113929 -2.672498
C 5.029981 1.602442 -1.450878
C -4.075019 -0.036795 -0.881537
C -5.133290 -0.624656 1.231594
C 4.530162 -0.097991 1.127615
C 4.819924 -1.807875 -0.577548
C -1.223147 -2.086895 -0.600679
C -4.908539 -0.952849 -1.557798
C -5.968446 -1.545461 0.557340
C -5.862864 -1.712166 -0.841346
C 5.034603 -0.978273 2.106741
C 5.324094 -2.697211 0.401818
C 5.436881 -2.287381 1.747766
H -1.711243 3.378405 0.369410
H 1.715840 -0.791293 -0.323595
H -5.072616 2.527387 1.344726
H -3.542238 3.417727 1.535610
H -4.072700 2.847625 -0.093928
H -4.190975 1.125169 3.257406
H -2.808057 0.011219 3.008174
H -2.525128 1.762386 3.198201
H -2.115212 -1.467014 1.221674
H -0.366991 -1.691643 1.306626
H 0.907508 4.197805 -0.553617
H 3.109895 3.235652 -1.190304
H 4.593388 -0.513793 -3.107855
H 2.915084 -0.928801 -2.615334
H 3.260951 0.649543 -3.364513
H 5.974766 1.102121 -1.728684
H 4.778968 2.319570 -2.253913
H 5.207340 2.165672 -0.517490
H -3.319173 0.519975 -1.446453
H -5.236204 -0.517212 2.316274
H 4.200369 0.906143 1.420410
H 4.741563 -2.152737 -1.613299
H -4.802812 -1.080849 -2.640736
H -6.698979 -2.132178 1.126285
H -6.508413 -2.426925 -1.364033
H 5.110562 -0.647905 3.149308
H 5.626708 -3.709915 0.110249
H 5.826919 -2.975324 2.506567
H -1.360172 -3.979103 -1.127028


