%chk=000190874.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190874

0 1
O 4.524148 0.027313 0.904699
O 3.045942 -1.693190 1.302399
O 2.023537 0.180663 -1.149586
O 3.914245 2.663731 -2.124842
O -4.638117 -0.456747 -0.948908
O -3.878535 1.452134 0.202343
O -3.227375 -2.069642 -1.673001
O -1.719842 1.697326 0.817316
N 0.028102 -0.163023 0.043281
C 3.227172 0.637405 0.883500
C 2.235239 -0.530860 1.141293
C 2.862825 1.195382 -0.510697
C 1.401710 -0.661226 -0.167217
C 4.409049 -1.424416 0.844362
C 4.050832 1.411222 -1.453797
C 4.579126 -1.911559 -0.578016
C 5.358884 -1.994850 1.871153
C -1.056140 -0.741791 -0.544357
C -2.341385 -0.224823 -0.446459
C -3.396258 -1.017902 -1.077921
C -2.583576 1.031255 0.246029
C -5.767482 -1.184800 -1.533059
C -4.207430 2.702972 0.894958
C -6.153431 -2.344165 -0.637889
C -4.318900 2.450213 2.383744
H 3.270756 1.417806 1.667610
H 1.628921 -0.465328 2.065296
H 2.242081 2.116727 -0.432479
H 1.422885 -1.687766 -0.604346
H 4.137095 0.587080 -2.186165
H 5.004567 1.518292 -0.893767
H -0.092312 0.763825 0.513001
H 4.378194 -2.987901 -0.657105
H 5.598717 -1.732232 -0.942169
H 3.889628 -1.401185 -1.267921
H 6.324714 -1.469985 1.844667
H 5.543696 -3.064323 1.714853
H 4.955520 -1.877268 2.888672
H -0.909965 -1.689642 -1.104591
H 3.193101 2.621412 -2.789700
H -5.491298 -1.507660 -2.552309
H -6.526934 -0.382342 -1.561904
H -5.175470 2.942020 0.417374
H -3.442688 3.459053 0.645255
H -6.273080 -2.022653 0.404634
H -7.093112 -2.806015 -0.959634
H -5.377187 -3.124807 -0.649358
H -4.964010 1.586974 2.595105
H -3.333505 2.233037 2.822393
H -4.733455 3.317458 2.909456


%chk=000190874-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190874

0 1
O 4.587310 0.089346 0.794802
O 3.140211 -1.649810 1.464901
O 2.082915 -0.055751 -1.204306
O 3.201308 2.052167 -2.851239
O -4.668161 -0.409586 -1.105064
O -3.815943 1.587030 0.424324
O -3.107070 -1.964894 -1.853283
O -1.577622 1.602841 1.031979
N 0.036030 -0.211132 0.112430
C 3.235012 0.669252 0.785208
C 2.275125 -0.513039 1.161932
C 2.753066 1.141401 -0.605348
C 1.379054 -0.737931 -0.095728
C 4.502386 -1.393224 0.908587
C 3.818019 1.605227 -1.599405
C 4.661892 -2.058715 -0.465529
C 5.524677 -1.851567 1.944630
C -1.063250 -0.700185 -0.512581
C -2.359466 -0.163212 -0.418134
C -3.379882 -0.926428 -1.181489
C -2.546219 1.048943 0.390899
C -5.720473 -1.167660 -1.848911
C -4.000652 2.815002 1.260999
C -6.272225 -2.313376 -0.995098
C -4.263305 2.442089 2.722776
H 3.233433 1.491593 1.519534
H 1.664323 -0.328468 2.061022
H 1.993530 1.943059 -0.482341
H 1.326048 -1.802859 -0.374296
H 4.549306 0.791888 -1.768177
H 4.351560 2.484376 -1.203189
H -0.157401 0.647982 0.677102
H 4.543542 -3.151534 -0.364853
H 5.668897 -1.849278 -0.866732
H 3.909680 -1.678667 -1.176587
H 6.544284 -1.610679 1.599522
H 5.449049 -2.941747 2.095379
H 5.339974 -1.341755 2.903358
H -0.942748 -1.592935 -1.139054
H 2.648578 1.306655 -3.200951
H -5.289206 -1.544238 -2.792867
H -6.485360 -0.401632 -2.054832
H -4.872545 3.302251 0.796349
H -3.105147 3.452626 1.162888
H -6.639580 -1.937261 -0.024548
H -7.116099 -2.798649 -1.520451
H -5.494753 -3.074233 -0.814592
H -5.122281 1.754021 2.803648
H -3.376189 1.963446 3.169779
H -4.494434 3.354448 3.303732


