%chk=000259377.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259377

0 1
O 2.287740 -2.081276 1.864552
N 1.138970 0.304761 1.001100
N 3.292488 -2.489321 -0.124434
C 3.553027 0.656896 0.571697
C 3.854164 1.693328 -0.533489
C 2.320062 -0.224107 0.281266
C 4.181546 1.013251 -1.869655
C 2.711821 2.699181 -0.690954
C -0.155302 0.154671 0.430148
C 2.614347 -1.664020 0.767190
C -1.264144 0.115243 1.264242
C -2.576469 0.105767 0.713649
C -0.329565 0.163844 -0.995758
C -2.748579 0.119895 -0.696922
C -1.589423 0.147698 -1.533491
C -3.739432 0.075526 1.552699
C -4.070210 0.105253 -1.242883
C -4.994439 0.061836 1.000122
C -5.165061 0.077292 -0.416169
H 3.409876 1.193213 1.533940
H 4.449052 0.024278 0.724755
H 4.766767 2.257221 -0.204751
H 2.116306 -0.229140 -0.826299
H 1.184030 0.103517 2.010280
H 4.469408 1.755052 -2.624452
H 3.321196 0.468178 -2.272089
H 5.014139 0.310190 -1.770692
H 2.951012 3.468929 -1.430913
H 2.492135 3.203762 0.257918
H 1.776075 2.218420 -1.001613
H -1.152945 0.092649 2.345470
H 0.550217 0.195806 -1.636691
H -1.728286 0.157273 -2.615019
H 3.516915 -3.436551 0.141266
H 3.613438 -2.187812 -1.024862
H -3.601477 0.063131 2.632199
H -4.188085 0.117037 -2.325296
H -5.881756 0.038796 1.631420
H -6.174059 0.066232 -0.821781


%chk=000259377-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259377

0 1
O 2.710932 -1.888441 2.324087
N 1.229312 -0.002718 0.948086
N 3.550148 -2.732763 0.329494
C 3.643841 0.530378 0.387853
C 3.625551 1.726117 -0.607194
C 2.460070 -0.488782 0.313900
C 3.695448 1.262507 -2.083241
C 2.455048 2.713652 -0.383328
C -0.043390 0.032596 0.360131
C 2.904001 -1.768671 1.077172
C -1.192210 0.065858 1.178993
C -2.504841 0.151476 0.627249
C -0.221917 0.086564 -1.071412
C -2.673658 0.193831 -0.813316
C -1.497005 0.157676 -1.629171
C -3.681300 0.186131 1.453351
C -3.992371 0.271665 -1.367573
C -4.954518 0.261135 0.884668
C -5.116739 0.305414 -0.538384
H 3.679581 0.915172 1.425741
H 4.588125 -0.030091 0.225059
H 4.565066 2.282640 -0.399139
H 2.254381 -0.748200 -0.739162
H 1.251870 -0.127278 1.967226
H 3.829475 2.128999 -2.756466
H 2.764505 0.753157 -2.398653
H 4.542004 0.569326 -2.252682
H 2.586662 3.612623 -1.015020
H 2.405335 3.040459 0.671195
H 1.479736 2.263198 -0.633856
H -1.078144 0.019332 2.269946
H 0.649219 0.087250 -1.734730
H -1.607939 0.197781 -2.719859
H 3.894456 -3.570716 0.799438
H 3.659802 -2.650813 -0.679718
H -3.564609 0.152645 2.543472
H -4.107110 0.304451 -2.458281
H -5.841036 0.287063 1.528726
H -6.122284 0.365277 -0.968899


