%chk=000259677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259677

0 1
I -2.316868 -1.639834 -2.705685
O 1.380285 1.824244 -1.309424
O 2.578842 2.557706 0.462455
O -0.601426 0.037892 2.505840
O -0.249332 -2.052922 2.073688
N -0.246844 -0.872507 1.779665
C 1.667967 -0.808854 0.184779
C 0.240044 -0.505053 0.415151
C 2.594034 0.198078 -0.139072
C -0.574982 0.009510 -0.517146
C 2.106111 -2.139595 0.291254
C -2.007237 0.307023 -0.362386
C 3.940961 -0.127886 -0.358836
C 3.445778 -2.459219 0.065450
C 4.363918 -1.454837 -0.260730
C -2.947610 -0.263930 -1.229481
C -2.453213 1.200928 0.625750
C 2.219887 1.637003 -0.227507
C -4.302801 0.035734 -1.130626
C -3.811390 1.512872 0.728853
C -4.734797 0.934335 -0.146812
C 0.925714 3.182485 -1.557522
H -0.157362 0.255388 -1.516351
H 1.388177 -2.922126 0.561104
H 4.658229 0.659525 -0.600113
H 3.776632 -3.495779 0.146955
H 5.410592 -1.706090 -0.433382
H -1.733555 1.638391 1.326309
H -5.028439 -0.420893 -1.807039
H -4.149507 2.204905 1.501509
H -5.794422 1.176463 -0.063792
H 1.761418 3.886203 -1.474861
H 0.141901 3.425636 -0.833976
H 0.539696 3.125805 -2.580720


%chk=000259677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259677

0 1
I -2.503103 -3.210249 -1.114435
O 1.517154 2.281697 0.055183
O 3.833496 2.457594 0.041446
O 0.957635 0.216158 2.444696
O -0.872344 1.371834 1.741124
N 0.097615 0.547657 1.538642
C 1.640709 -0.580264 -0.097057
C 0.259312 -0.091949 0.208968
C 2.798031 0.257288 -0.179159
C -0.800733 -0.396432 -0.602547
C 1.798403 -1.972299 -0.322816
C -2.254232 -0.132902 -0.537441
C 4.062261 -0.320282 -0.462840
C 3.058778 -2.533692 -0.616782
C 4.200489 -1.704430 -0.680938
C -3.184925 -1.176762 -0.823609
C -2.790590 1.174537 -0.340606
C 2.801475 1.745478 -0.012315
C -4.574511 -0.948877 -0.882230
C -4.175269 1.419015 -0.419503
C -5.071276 0.359766 -0.683437
C 1.428956 3.743718 0.281606
H -0.503503 -0.985067 -1.482839
H 0.921145 -2.622628 -0.237293
H 4.926702 0.349590 -0.511170
H 3.147840 -3.613160 -0.778737
H 5.185383 -2.130796 -0.897257
H -2.097511 1.991026 -0.134542
H -5.262118 -1.775511 -1.080741
H -4.553279 2.435313 -0.269064
H -6.150080 0.540141 -0.737288
H 1.771770 4.282409 -0.617548
H 2.052288 4.032641 1.143467
H 0.364428 3.930038 0.480364


