%chk=000206223.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206223

0 1
O 4.282728 0.312437 -0.006520
O -4.276650 0.348783 0.004585
O -0.010441 -2.842016 0.000543
N 1.090773 -0.772061 -0.326279
N -1.094052 -0.762472 0.325391
C 3.459225 -0.842843 0.355877
C -3.463067 -0.813872 -0.356641
C 2.433739 -1.244694 -0.690801
C -2.440965 -1.223376 0.690398
C 4.924411 -1.000745 0.061921
C -4.929532 -0.958942 -0.062439
C 0.696352 0.590397 -0.193870
C -0.688082 0.596460 0.191652
C -0.005316 -1.628918 -0.000092
C 1.397648 1.778443 -0.371326
C -1.379276 1.790582 0.367967
C 0.692801 2.972997 -0.179996
C -0.664319 2.978928 0.175488
H 3.103195 -0.818218 1.392494
H -3.106919 -0.793391 -1.393312
H 2.404778 -2.359630 -0.793455
H 2.712783 -0.821149 -1.687546
H -2.421426 -2.338412 0.794136
H -2.716376 -0.796516 1.686748
H 5.643334 -1.106459 0.872123
H 5.270075 -1.380493 -0.896567
H -5.649384 -1.059362 -0.872488
H -5.278367 -1.334713 0.896469
H 2.456132 1.774079 -0.635719
H -2.437757 1.795446 0.632362
H 1.214050 3.920992 -0.311219
H -1.177497 3.931439 0.305814


%chk=000206223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206223

0 1
O 4.256324 0.348626 0.214516
O -4.250387 0.384570 -0.215597
O -0.010425 -2.838638 0.000175
N 1.099331 -0.722323 -0.244053
N -1.102135 -0.712741 0.242555
C 3.502003 -0.955360 0.398847
C -3.506986 -0.925748 -0.399325
C 2.411615 -1.250303 -0.616580
C -2.418786 -1.229102 0.615992
C 4.939799 -0.976983 -0.016578
C -4.944763 -0.935167 0.016626
C 0.702062 0.631740 -0.152951
C -0.693361 0.637800 0.150323
C -0.005070 -1.573837 -0.000452
C 1.426481 1.827255 -0.299205
C -1.407623 1.839534 0.295529
C 0.708592 3.039948 -0.147183
C -0.679484 3.045968 0.142381
H 3.250900 -1.164337 1.446498
H -3.257967 -1.137478 -1.446919
H 2.282754 -2.345949 -0.710452
H 2.717254 -0.846812 -1.601643
H -2.299309 -2.325722 0.710872
H -2.720606 -0.822057 1.600776
H 5.710449 -1.235805 0.718680
H 5.191349 -1.185514 -1.064832
H -5.717821 -1.188070 -0.718164
H -5.197607 -1.140922 1.065118
H 2.502234 1.818122 -0.496900
H -2.483403 1.839609 0.493285
H 1.241765 3.990900 -0.252042
H -1.204581 4.001498 0.246402


