%chk=000258125.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258125

0 1
O 1.815268 2.257168 1.068382
O 5.234031 -0.759364 -0.156149
O 3.609799 0.143955 -1.449030
N -0.214329 1.319470 0.573404
N 1.081538 -1.232517 0.601789
N -2.310013 0.254266 0.106577
N -4.330633 -0.916048 -0.317563
N -2.392385 -2.223113 -0.033386
C -0.962107 0.159613 0.345766
C -0.848029 2.674552 0.466393
C 1.203876 1.241092 0.819349
C 1.778513 -0.145101 0.786985
C -0.287742 -1.109900 0.397269
C 3.264449 -0.227599 0.966103
C -0.901431 3.137171 -0.984027
C -1.080642 -2.281130 0.195195
C -2.985369 -0.939216 -0.076071
C -5.092413 0.360967 -0.394832
C 3.974720 -0.231702 -0.364035
C -6.550313 0.077781 -0.725410
C 6.109483 -0.829898 -1.312705
H -1.869987 2.627275 0.907304
H -0.240325 3.380525 1.083129
H 3.544115 -1.138264 1.550151
H 3.636708 0.638922 1.569655
H 0.099565 3.182574 -1.434841
H -1.509880 2.463241 -1.602026
H -1.338465 4.139816 -1.058132
H -0.607606 -3.275921 0.225627
H -4.827067 -1.795882 -0.454259
H -4.996488 0.901518 0.577697
H -4.624457 1.019935 -1.166037
H -6.668963 -0.428359 -1.692553
H -7.040192 -0.541211 0.037571
H -7.119409 1.016142 -0.786412
H 7.012369 -1.292178 -0.900489
H 6.300334 0.179914 -1.689071
H 5.646878 -1.451094 -2.086316


%chk=000258125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258125

0 1
O 2.013579 1.915671 0.719927
O 5.333152 -0.253759 -0.021056
O 3.511569 -0.203691 -1.472323
N -0.162208 1.081327 0.414727
N 0.905911 -1.550753 0.697590
N -2.344038 0.189045 0.106935
N -4.464827 -0.783199 -0.166861
N -2.691689 -2.254749 0.202387
C -1.016404 -0.016597 0.329612
C -0.679236 2.466675 0.237192
C 1.239963 0.914213 0.632269
C 1.706963 -0.492677 0.757878
C -0.452273 -1.328545 0.491541
C 3.189239 -0.689259 0.946505
C -0.603987 2.913060 -1.236426
C -1.369860 -2.414965 0.415276
C -3.124805 -0.936632 0.053717
C -5.125631 0.518353 -0.352145
C 3.973500 -0.350614 -0.320708
C -6.626194 0.323493 -0.622566
C 6.218701 0.059079 -1.169286
H -1.720087 2.474308 0.595784
H -0.051913 3.118707 0.866804
H 3.380876 -1.745104 1.205752
H 3.578361 -0.053962 1.761299
H 0.437135 2.887160 -1.599740
H -1.225041 2.263217 -1.876593
H -0.975740 3.949466 -1.329545
H -0.992574 -3.436357 0.532753
H -5.010374 -1.646450 -0.196309
H -4.967991 1.141492 0.549572
H -4.641909 1.055146 -1.190524
H -6.794946 -0.270890 -1.539182
H -7.124833 -0.185837 0.222690
H -7.115362 1.302716 -0.760810
H 7.229765 0.097391 -0.740630
H 5.935953 1.028653 -1.611990
H 6.140657 -0.727731 -1.938516


