%chk=000261684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261684

0 1
O -0.965223 -0.725776 0.361537
O -0.239622 -2.819992 -0.107442
O 6.166401 0.037259 -0.316909
O 5.305939 1.956356 0.192230
N 5.224849 0.763841 -0.049189
C -3.181966 -0.248189 1.333959
C -4.314405 -0.268910 -0.657357
C -3.162003 1.244794 0.896931
C -3.947194 1.231566 -0.478952
C -4.601815 -0.666802 0.826432
C -2.351822 -1.193999 0.419764
C -3.033981 -1.093042 -0.964220
C -1.807052 1.918114 0.594722
C -2.982258 1.826777 -1.470609
C -1.838850 2.211568 -0.886971
C 0.006828 -1.650370 0.078359
C 1.349389 -0.996474 0.051279
C 2.463601 -1.793052 -0.254112
C 1.496722 0.370462 0.323554
C 3.735828 -1.219706 -0.288126
C 2.764176 0.952395 0.292096
C 3.871427 0.148453 -0.014135
H -2.979946 -0.390852 2.401560
H -5.131405 -0.445986 -1.365398
H -3.710216 1.837988 1.655787
H -4.869037 1.844876 -0.427375
H -5.419199 -0.100821 1.288422
H -4.834680 -1.729305 0.964247
H -2.329342 -2.232472 0.812551
H -3.272207 -2.085160 -1.375301
H -2.381217 -0.593469 -1.699318
H -0.943609 1.266936 0.853584
H -1.683031 2.845029 1.181127
H -3.252189 1.912568 -2.508767
H -0.992158 2.681035 -1.358956
H 2.327642 -2.860138 -0.463462
H 0.603353 0.974256 0.558545
H 4.620199 -1.822752 -0.524375
H 2.902174 2.019097 0.501489


%chk=000261684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261684

0 1
O -0.888448 -0.582783 0.433063
O -0.218566 -2.691804 -0.312610
O 6.412070 -0.302937 -0.359590
O 5.674700 1.742344 0.329969
N 5.475395 0.513457 -0.010903
C -3.225558 -0.191499 1.346119
C -4.347262 -0.387915 -0.649340
C -3.368695 1.295032 0.875192
C -4.123246 1.159552 -0.516773
C -4.594971 -0.766600 0.846425
C -2.300775 -1.076078 0.472510
C -2.991397 -1.099727 -0.931540
C -2.101883 2.170930 0.610771
C -3.196255 1.845866 -1.502485
C -2.104584 2.385060 -0.897054
C 0.060061 -1.512329 0.018796
C 1.447955 -0.946225 0.021373
C 2.511332 -1.806240 -0.358344
C 1.716922 0.397980 0.387452
C 3.836397 -1.335398 -0.371947
C 3.037821 0.883133 0.378599
C 4.077447 0.005988 -0.000984
H -3.021258 -0.294794 2.424458
H -5.146955 -0.660531 -1.357008
H -4.016708 1.795493 1.618060
H -5.115799 1.653739 -0.498625
H -5.460293 -0.247076 1.293712
H -4.706658 -1.854016 1.010749
H -2.253258 -2.096047 0.896505
H -3.128366 -2.134529 -1.286853
H -2.385846 -0.556382 -1.676847
H -1.175718 1.681056 0.958215
H -2.169572 3.140878 1.142824
H -3.405271 1.898935 -2.576768
H -1.305778 2.928272 -1.415573
H 2.274843 -2.837587 -0.637423
H 0.889555 1.050424 0.675454
H 4.675423 -1.974223 -0.658542
H 3.277299 1.912684 0.656165


