%chk=000226006.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226006

0 1
O -2.796216 2.828622 -0.299903
N -0.834909 1.652991 0.012166
N -2.767733 -3.666397 0.232588
N 5.212165 -0.025982 -0.026839
C -0.433377 -0.764607 0.049746
C 1.028704 -0.537092 0.034548
C -1.352147 0.314684 0.028841
C -0.907680 -2.077935 0.084985
C -2.734178 0.051606 0.038207
C -2.292774 -2.333437 0.098698
C 1.684264 -0.225015 -1.167102
C 1.771893 -0.653592 1.220237
C -3.203201 -1.257152 0.069237
C 3.060745 -0.017817 -1.190725
C 3.148711 -0.448981 1.216574
C 3.804521 -0.137896 0.004385
C -1.588274 2.828091 -0.153769
C -0.758810 4.085596 -0.131822
H -0.195688 -2.900664 0.111088
H -3.450411 0.883519 0.017144
H 1.107231 -0.147404 -2.090024
H 1.261972 -0.906876 2.151442
H -4.274955 -1.442431 0.084509
H 0.179602 1.728744 0.123778
H 3.560073 0.210957 -2.127903
H 3.715675 -0.550221 2.137771
H -3.709521 -3.826271 -0.097788
H -2.137679 -4.386787 -0.092235
H 5.674312 0.176760 0.846412
H 5.614315 0.473139 -0.805426
H -0.235871 4.226262 0.822652
H -1.414793 4.961640 -0.269912
H -0.014967 4.113348 -0.937761


%chk=000226006-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226006

0 1
O -2.885406 2.925516 -0.429081
N -0.919406 1.671521 -0.106106
N -2.764043 -3.689655 0.325321
N 5.258282 0.071605 -0.012879
C -0.458026 -0.737565 0.055184
C 1.018513 -0.493556 0.046959
C -1.408482 0.329045 -0.062928
C -0.932527 -2.062713 0.195209
C -2.795670 0.029248 -0.074978
C -2.320288 -2.368968 0.194835
C 1.657813 0.217436 -1.008937
C 1.851876 -1.019347 1.072854
C -3.244524 -1.297407 0.047154
C 3.052690 0.407242 -1.035758
C 3.247000 -0.837633 1.060965
C 3.875430 -0.115545 0.004259
C -1.626537 2.857439 -0.266205
C -0.761517 4.118849 -0.225313
H -0.198826 -2.875077 0.267192
H -3.505265 0.853037 -0.174506
H 1.055409 0.590935 -1.845852
H 1.388636 -1.565186 1.903143
H -4.321760 -1.503907 0.030906
H 0.093690 1.756369 0.016077
H 3.512347 0.947662 -1.872656
H 3.857478 -1.249753 1.874150
H -3.755459 -3.906856 0.302990
H -2.103922 -4.456444 0.407647
H 5.844772 -0.309205 0.723556
H 5.706852 0.576228 -0.771487
H -1.061279 4.733416 0.641980
H -0.958981 4.715867 -1.132100
H 0.322130 3.916805 -0.157794


