%chk=000298234.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298234

0 1
O 0.839628 -0.306488 -0.758992
O 3.883749 -0.139116 0.401912
O 2.094430 -1.544681 0.720328
O 2.595320 2.730178 -1.036345
O -1.063681 1.302807 1.219028
N -1.253460 1.423076 -1.063616
C 2.723948 0.701459 0.347605
C 2.572000 1.302747 -1.072337
C 1.519834 -0.268603 0.523496
C 1.147947 0.880966 -1.523995
C 3.489915 -1.544971 0.297400
C 0.102114 1.980799 -1.222797
C 4.278867 -2.319135 1.326818
C 3.599278 -2.011998 -1.138995
C -1.669584 0.991293 0.206542
C -2.940729 0.196815 0.195580
C -2.910193 -1.142308 -0.214428
C -4.134085 0.784771 0.629763
C -4.088013 -1.894084 -0.195529
C -5.309441 0.027237 0.641711
C -5.286297 -1.309141 0.229283
H 2.852626 1.459889 1.140155
H 3.368298 0.934159 -1.752181
H 0.762264 -0.108364 1.311541
H 1.104304 0.532684 -2.574264
H 0.105457 2.738579 -2.036340
H 0.382603 2.533395 -0.288036
H 5.286147 -2.565093 0.971701
H 4.388880 -1.737419 2.254780
H 3.763647 -3.253560 1.591009
H 2.740687 -1.656272 -1.730225
H 4.518869 -1.646244 -1.609603
H 3.592334 -3.106874 -1.207837
H 3.502575 3.048421 -0.836257
H -1.662033 1.003719 -1.894816
H -1.969975 -1.596462 -0.533293
H -4.142938 1.823262 0.962019
H -4.071050 -2.937089 -0.507951
H -6.241774 0.478352 0.977789
H -6.202868 -1.897708 0.242679


%chk=000298234-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298234

0 1
O 1.017945 -0.555795 -0.740814
O 4.104198 0.036327 0.386683
O 2.390042 -1.427191 1.062553
O 2.675077 2.578987 -1.581481
O -1.187953 0.965350 1.203462
N -1.272193 1.198591 -1.108620
C 2.837635 0.756051 0.180686
C 2.585723 1.145298 -1.306098
C 1.718375 -0.268900 0.551690
C 1.137296 0.660711 -1.568857
C 3.797315 -1.416202 0.568431
C 0.084041 1.743109 -1.192355
C 4.689669 -1.955450 1.680061
C 3.911463 -2.177964 -0.760621
C -1.804026 0.782207 0.102288
C -3.169100 0.146141 0.054777
C -3.682396 -0.504550 -1.097788
C -3.951570 0.181156 1.236847
C -4.968079 -1.088498 -1.073043
C -5.237387 -0.397104 1.259520
C -5.752040 -1.029234 0.102457
H 2.847667 1.649409 0.827676
H 3.297465 0.576009 -1.935412
H 0.965212 0.051406 1.288245
H 0.983510 0.324976 -2.608678
H 0.127255 2.555464 -1.937341
H 0.318611 2.178652 -0.206931
H 5.748426 -1.904620 1.373749
H 4.549703 -1.356308 2.593428
H 4.431394 -3.006094 1.895051
H 3.167837 -1.809745 -1.485532
H 4.928251 -2.063053 -1.175292
H 3.715515 -3.250738 -0.590608
H 3.617969 2.867565 -1.496678
H -1.819876 1.089622 -1.961870
H -3.071362 -0.605099 -2.003280
H -3.524075 0.660015 2.123732
H -5.351978 -1.599425 -1.962878
H -5.836527 -0.359584 2.175889
H -6.749430 -1.482493 0.120254


