%chk=000222983.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222983

0 1
O 2.883223 1.759331 -1.400838
O 4.479343 0.567177 0.691789
O -2.257796 -4.469981 -0.814966
N -0.523963 -2.955896 -0.603527
C -1.159042 -0.718632 0.328142
C -1.358279 -1.766736 -0.806430
C 0.320381 -0.321200 0.435369
C -2.083798 0.502082 0.179957
C 0.890503 0.576949 -0.502611
C 1.158734 -0.886482 1.424299
C -1.977842 1.554615 1.129465
C -3.061555 0.618739 -0.840497
C 2.262245 0.911604 -0.464718
C 2.527353 -0.541934 1.483340
C 3.099647 0.356303 0.557274
C -2.821387 2.682537 1.067480
C -3.906587 1.752274 -0.909478
C -3.792718 2.787773 0.043094
C -1.041554 -4.238751 -0.609681
C -0.034771 -5.348047 -0.314790
C 2.041716 2.343445 -2.449247
C 5.050729 1.903570 0.430461
H -1.430031 -1.231024 1.274343
H -2.401487 -2.127523 -0.833781
H -1.127638 -1.299860 -1.785893
H 0.240614 1.020151 -1.264433
H 0.740309 -1.576381 2.166300
H 0.473212 -2.814102 -0.425428
H -1.220298 1.484033 1.919598
H -3.184220 -0.172364 -1.586898
H 3.185994 -0.955535 2.253354
H -2.724336 3.477741 1.815463
H -4.656879 1.819971 -1.705621
H -4.450791 3.662391 -0.008548
H -0.323695 -6.249812 -0.876797
H 1.001741 -5.071242 -0.576718
H -0.067453 -5.599704 0.761333
H 1.238525 2.971853 -2.018697
H 1.596210 1.557453 -3.089064
H 2.722145 2.966874 -3.047764
H 4.497941 2.682754 0.988791
H 5.035400 2.140539 -0.644189
H 6.084150 1.836648 0.804564


%chk=000222983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222983

0 1
O 2.879812 1.745195 -1.463899
O 4.502749 0.554598 0.553555
O -2.296127 -4.479099 -0.707517
N -0.533445 -2.960496 -0.575796
C -1.147902 -0.709263 0.336869
C -1.366473 -1.771010 -0.781412
C 0.334465 -0.315398 0.416668
C -2.070441 0.512680 0.187014
C 0.890596 0.573829 -0.539172
C 1.184904 -0.876501 1.397376
C -1.956037 1.570382 1.129782
C -3.052940 0.626687 -0.829121
C 2.263877 0.901960 -0.523077
C 2.557552 -0.538716 1.431249
C 3.114992 0.347091 0.487155
C -2.795576 2.701142 1.065079
C -3.894169 1.762909 -0.900713
C -3.771516 2.803824 0.044828
C -1.058788 -4.244349 -0.545171
C -0.043539 -5.359576 -0.304879
C 2.042627 2.289453 -2.537683
C 4.997950 1.947741 0.544258
H -1.406129 -1.209318 1.293056
H -2.411291 -2.128098 -0.788626
H -1.147778 -1.317932 -1.769989
H 0.229064 1.015064 -1.292129
H 0.773886 -1.558553 2.150678
H 0.467779 -2.820636 -0.423674
H -1.195289 1.501683 1.917037
H -3.182643 -0.168574 -1.569898
H 3.227867 -0.954024 2.190345
H -2.691863 3.500503 1.807704
H -4.648406 1.828478 -1.693292
H -4.426526 3.680605 -0.008882
H -0.049922 -6.044950 -1.170138
H 0.985816 -4.993316 -0.146794
H -0.356018 -5.945620 0.576439
H 1.236446 2.931993 -2.134516
H 1.601927 1.479117 -3.149549
H 2.725345 2.891372 -3.155123
H 4.576833 2.510878 1.399755
H 4.743296 2.451809 -0.401582
H 6.089033 1.858036 0.657587


