%chk=000259727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259727

0 1
O 0.792278 0.876404 0.478437
O 0.721576 -1.502432 0.072604
O -3.350670 -0.459657 -0.002152
O -0.275833 -0.426075 -1.853147
O -0.103380 2.911714 0.080321
O -1.098928 -2.468031 1.007888
O -4.494127 1.425270 0.550522
N 4.418347 0.631072 0.073497
C 3.157605 0.418478 0.903140
C 2.133089 1.427735 0.326724
C 2.500690 1.582970 -1.153895
C 4.026669 1.389577 -1.168572
C 2.855142 -1.070658 0.784745
C 4.958179 -0.748610 -0.216452
C -2.150704 0.234542 -0.477301
C 3.868717 -1.713452 0.180217
C -1.580673 1.062819 0.708420
C -1.277721 -0.975431 -1.000652
C 1.582203 -1.684456 1.246115
C -0.275885 1.755690 0.373691
C -2.519648 1.143505 -1.639859
C -0.621921 -1.757571 0.162173
C -1.466463 0.303394 2.026917
C -2.071189 -1.940375 -1.869317
C -4.456768 0.222269 0.464857
C -5.496351 -0.782229 0.817580
H 3.403376 0.671739 1.962844
H 2.160845 2.396344 0.872672
H 2.192724 2.562314 -1.558364
H 1.978312 0.814410 -1.761381
H 4.367411 0.898438 -2.098726
H 4.552298 2.368289 -1.106503
H 5.865587 -0.878505 0.416100
H 5.275393 -0.877285 -1.268966
H 3.954927 -2.766219 -0.030355
H -2.335883 1.900846 0.871216
H 1.645620 -2.766109 1.456172
H 1.107914 -1.150132 2.092922
H -3.054211 2.046842 -1.308912
H -1.623540 1.464524 -2.195001
H -3.170533 0.633117 -2.360909
H -2.206100 -0.511845 2.087305
H -0.475189 -0.154172 2.171438
H -1.642052 0.966401 2.882996
H -2.964946 -2.306548 -1.342777
H -2.393190 -1.451311 -2.799559
H -1.461491 -2.804004 -2.166939
H 0.542244 -0.143503 -1.329731
H -5.105397 -1.814078 0.811416
H -6.336837 -0.741526 0.106372
H -5.908422 -0.582991 1.819869


%chk=000259727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259727

0 1
O 0.736466 0.827535 0.509101
O 0.756495 -1.776696 -0.415096
O -3.441209 -0.473750 0.130995
O -0.480765 -0.211406 -2.028901
O 0.014032 2.871612 -0.342225
O -0.997185 -2.067671 1.094185
O -4.702037 1.416840 0.726558
N 4.444855 0.633672 0.382594
C 3.104256 0.194195 0.923608
C 2.141234 1.264437 0.346677
C 2.661179 1.486669 -1.085193
C 4.191537 1.514493 -0.823885
C 2.979671 -1.278688 0.466921
C 5.236101 -0.606845 0.116969
C -2.311613 0.286025 -0.514263
C 4.196239 -1.715915 0.041192
C -1.660877 1.279175 0.540433
C -1.380730 -0.872881 -1.073985
C 1.775255 -2.156693 0.625408
C -0.257787 1.753344 0.146048
C -2.856406 1.110558 -1.703017
C -0.566342 -1.606143 0.020622
C -1.670870 0.843645 2.030186
C -2.180554 -1.976531 -1.816474
C -4.557221 0.174579 0.665928
C -5.545642 -0.859559 1.163847
H 3.081373 0.231399 2.031937
H 2.257512 2.203547 0.921666
H 2.276604 2.415138 -1.530486
H 2.386185 0.634345 -1.731586
H 4.765789 1.156513 -1.698856
H 4.525853 2.545617 -0.602329
H 5.955559 -0.802818 0.940034
H 5.833485 -0.502469 -0.808691
H 4.428399 -2.741896 -0.263215
H -2.278799 2.191012 0.469403
H 2.020195 -3.217582 0.450706
H 1.285312 -2.052730 1.610955
H -3.560355 1.872554 -1.335590
H -2.016643 1.604891 -2.214948
H -3.376623 0.469546 -2.433436
H -2.703437 0.674105 2.372709
H -1.086168 -0.065243 2.217716
H -1.255333 1.664989 2.642686
H -2.896300 -2.469379 -1.141345
H -2.721020 -1.534642 -2.668580
H -1.474264 -2.726114 -2.215360
H 0.424473 -0.601089 -1.887104
H -5.053200 -1.540393 1.879222
H -5.906636 -1.475099 0.321195
H -6.396949 -0.356704 1.644768


