%chk=000224949.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224949

0 1
O 0.457434 1.406936 -1.109941
N 4.155445 0.320428 0.121701
C -2.006805 0.255849 -0.083530
C -2.655501 0.635351 1.263336
C -2.935517 -0.666735 -0.899179
C -4.024932 1.291416 1.043911
C -4.304706 -0.009391 -1.116001
C -4.951712 0.387046 0.218829
C -0.652891 -0.381490 0.124133
C 0.506960 0.224970 -0.396993
C -0.498984 -1.581005 0.831482
C 1.793520 -0.330044 -0.231465
C 0.764030 -2.148929 1.009162
C 2.996836 0.346183 -0.835335
C 1.901419 -1.528693 0.480301
C 3.891595 1.201409 1.298498
C 5.402037 0.754910 -0.578781
H -1.867876 1.207755 -0.674663
H -1.988398 1.315734 1.824021
H -2.768023 -0.266067 1.895346
H -3.061625 -1.633529 -0.375718
H -2.466710 -0.908696 -1.870878
H -3.900166 2.265509 0.533890
H -4.492068 1.517361 2.020878
H -4.969424 -0.702608 -1.664968
H -4.197542 0.883605 -1.760700
H -5.196628 -0.523498 0.798905
H -5.913278 0.900635 0.034068
H -1.377124 -2.074636 1.246715
H 3.291682 -0.215824 -1.752410
H 2.730173 1.376462 -1.169612
H 0.867024 -3.080046 1.561650
H 2.890680 -1.969918 0.626788
H -0.486293 1.740814 -1.178234
H 2.979338 0.849930 1.809496
H 3.758780 2.266219 1.059175
H 4.724080 1.103589 2.012019
H 5.370970 1.771697 -0.996207
H 5.619706 0.048751 -1.395743
H 6.245394 0.698551 0.128055


%chk=000224949-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000224949

0 1
O 0.425761 1.565286 -1.144544
N 4.257099 0.292319 0.044279
C -2.096336 0.290880 -0.106177
C -2.811440 0.681091 1.220928
C -2.971984 -0.702695 -0.925130
C -4.234876 1.231472 0.969372
C -4.394736 -0.147259 -1.171069
C -5.091614 0.231100 0.157662
C -0.686984 -0.252209 0.141987
C 0.482138 0.388005 -0.359664
C -0.508315 -1.438402 0.899282
C 1.786978 -0.117017 -0.112154
C 0.775055 -1.964852 1.149983
C 3.005836 0.594683 -0.691484
C 1.915465 -1.302280 0.643535
C 4.310910 0.961593 1.360664
C 5.463645 0.559847 -0.761197
H -2.053814 1.227686 -0.713632
H -2.197560 1.421198 1.769303
H -2.875905 -0.216785 1.867780
H -3.041196 -1.659136 -0.368631
H -2.471499 -0.933298 -1.885184
H -4.167771 2.189393 0.411835
H -4.724218 1.461182 1.935723
H -4.998433 -0.892747 -1.724031
H -4.331192 0.753558 -1.817348
H -5.247912 -0.687587 0.760371
H -6.093255 0.658115 -0.042770
H -1.391154 -1.954631 1.295570
H 3.143458 0.264729 -1.741047
H 2.799529 1.690746 -0.742001
H 0.887617 -2.884036 1.734991
H 2.928542 -1.678862 0.821456
H -0.513510 1.861851 -1.245807
H 3.419927 0.691712 1.952963
H 4.346920 2.078147 1.280299
H 5.207193 0.626697 1.913357
H 5.591969 1.639757 -1.030696
H 5.425437 -0.023940 -1.698391
H 6.361126 0.244690 -0.198384


