%chk=000274321.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274321

0 1
O 2.474814 -2.409708 -0.568934
O -2.541941 -2.253946 0.623939
O 0.555143 1.103903 -2.086169
O -0.433477 1.199456 2.024399
N 1.555047 2.203515 -0.345191
N -1.373448 2.292443 0.246248
C 2.230216 -0.465806 0.852557
C -2.193349 -0.375044 -0.861786
C 1.826882 -0.211017 -0.579117
C -1.775675 -0.094542 0.560935
C 2.627662 -1.953400 0.835812
C -2.671088 -1.837405 -0.795465
C 1.992924 -1.349139 -1.309450
C -2.002629 -1.196803 1.328909
C 0.724558 3.410454 -0.555025
C -0.478821 3.459082 0.416675
C 1.249112 1.034178 -1.070284
C -1.130874 1.133285 1.010642
C 1.766698 -1.656212 -2.729313
C -1.792239 -1.467842 2.758510
H 3.071291 0.177698 1.165641
H 1.386943 -0.259928 1.547777
H -2.998367 0.302366 -1.197319
H -1.340623 -0.238780 -1.562610
H 3.682395 -2.145962 1.075565
H 1.959981 -2.606965 1.414819
H -3.734984 -1.980224 -1.029518
H -2.040541 -2.545417 -1.351621
H 1.364741 4.308215 -0.411888
H 0.374353 3.428515 -1.616101
H -0.127156 3.493386 1.476888
H -1.069760 4.384835 0.243332
H 1.936389 2.113512 0.596591
H -1.759313 2.191532 -0.692596
H 1.297021 -2.640399 -2.875026
H 2.711512 -1.663148 -3.297490
H 1.114018 -0.885192 -3.192232
H -1.375847 -2.470353 2.937586
H -2.735668 -1.405163 3.325537
H -1.098801 -0.717881 3.196074


%chk=000274321-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274321

0 1
O 2.508760 -2.434859 -0.529059
O -2.579341 -2.271694 0.604082
O 0.747463 1.200922 -2.217238
O -0.544152 1.299594 2.107714
N 1.501682 2.164843 -0.229324
N -1.331520 2.255222 0.128978
C 2.416204 -0.411685 0.849764
C -2.446927 -0.292006 -0.832371
C 1.887437 -0.198270 -0.574270
C -1.836982 -0.072196 0.558043
C 2.668740 -1.944176 0.887404
C -2.781968 -1.809076 -0.816133
C 1.986781 -1.371557 -1.283044
C -1.964802 -1.220749 1.302680
C 0.795033 3.423538 -0.476088
C -0.550001 3.481024 0.315279
C 1.339735 1.070608 -1.083360
C -1.195287 1.175587 1.005080
C 1.663727 -1.709154 -2.703122
C -1.590571 -1.542836 2.713869
H 3.350709 0.156978 1.027307
H 1.675565 -0.107544 1.613758
H -3.357365 0.322337 -0.979859
H -1.731649 -0.050058 -1.641349
H 3.682852 -2.228601 1.208258
H 1.918833 -2.483429 1.492230
H -3.824250 -2.045749 -1.080439
H -2.092274 -2.402986 -1.440651
H 1.429522 4.282803 -0.188372
H 0.605057 3.473593 -1.561832
H -0.354254 3.572922 1.397275
H -1.136859 4.359241 -0.012695
H 1.817325 1.989790 0.726826
H -1.708295 2.078153 -0.804124
H 0.928039 -2.533768 -2.746159
H 2.571726 -2.055281 -3.230560
H 1.255943 -0.817280 -3.201891
H -0.882237 -2.392059 2.740691
H -2.485461 -1.848228 3.286688
H -1.129840 -0.657815 3.177314


