%chk=000219571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219571

0 1
O 2.660401 2.123330 0.805126
O 3.430623 -2.388509 0.123621
N 1.665905 -1.003592 -0.569983
N 3.352060 -0.088276 0.653081
C 1.282445 0.435384 -0.438011
C -0.019060 0.608770 0.362267
C -1.257159 0.053118 -0.350201
C -2.525962 0.300286 0.478180
C 2.477085 1.002490 0.411050
C 1.268320 1.126375 -1.795463
C -3.770051 -0.254432 -0.227969
C 2.876842 -1.317654 0.065345
C -5.040313 -0.007280 0.598299
C -6.282364 -0.556982 -0.099038
H -0.159676 1.690812 0.575477
H 0.085153 0.122416 1.354899
H -1.366406 0.522199 -1.347998
H -1.138326 -1.032497 -0.531908
H -2.651561 1.384899 0.663993
H -2.422394 -0.165677 1.477641
H 1.096478 -1.673753 -1.062555
H 2.205774 0.975092 -2.347890
H 0.455597 0.756283 -2.433519
H 1.126734 2.211641 -1.683756
H -3.649960 -1.339520 -0.411967
H -3.878443 0.209880 -1.227040
H 4.221821 -0.031960 1.174850
H -4.936447 -0.473419 1.597890
H -5.165131 1.077874 0.782678
H -7.183663 -0.376130 0.497850
H -6.209947 -1.638398 -0.261860
H -6.438572 -0.088071 -1.077191


%chk=000219571-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219571

0 1
O 2.673599 2.170225 0.772863
O 3.414267 -2.458833 0.230681
N 1.696221 -0.999683 -0.549671
N 3.329563 -0.111091 0.697992
C 1.337055 0.435938 -0.458856
C -0.001399 0.664022 0.307886
C -1.260763 0.119818 -0.401463
C -2.532798 0.297100 0.460124
C 2.510094 0.981986 0.408401
C 1.357376 1.128276 -1.843703
C -3.811375 -0.231186 -0.227741
C 2.859952 -1.339863 0.123138
C -5.082366 -0.055240 0.634396
C -6.356106 -0.589638 -0.054913
H -0.102504 1.752790 0.481385
H 0.086246 0.187564 1.304671
H -1.410955 0.634981 -1.370880
H -1.132700 -0.959755 -0.628237
H -2.662932 1.372257 0.702415
H -2.394636 -0.225316 1.429487
H 1.158766 -1.696165 -1.061489
H 2.330203 0.975949 -2.342157
H 0.566783 0.724178 -2.498995
H 1.194881 2.212593 -1.718880
H -3.681941 -1.306751 -0.470802
H -3.952552 0.291873 -1.196948
H 4.182747 -0.068973 1.255710
H -4.939157 -0.575217 1.603655
H -5.213182 1.019511 0.875157
H -7.248669 -0.454309 0.582964
H -6.262509 -1.668878 -0.279812
H -6.541405 -0.063464 -1.010480


