%chk=000233479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233479

0 1
O 5.067323 1.116771 -0.264611
N -0.369129 0.234291 0.581686
C 4.261431 -1.568938 0.573145
C 3.280504 -0.442011 0.332472
C 1.009574 0.445317 0.269497
C 1.903110 -0.614021 0.498682
C -2.690277 -0.152348 0.148729
C 3.733463 0.830778 -0.065172
C -3.744988 -0.228625 -0.782215
C 1.487713 1.722330 -0.125503
C -1.289462 0.046731 -0.315271
C 4.011554 -2.728488 -0.397617
C 4.209414 -2.035358 2.031956
C -3.507764 -0.116244 -2.263132
C 2.861914 1.905090 -0.292227
C -1.065554 0.011536 -1.779582
C -2.067966 -0.060686 -2.660905
C -2.975496 -0.265225 1.522027
C -5.062207 -0.410524 -0.329151
C 0.541383 2.853044 -0.353346
C -4.285648 -0.447598 1.963312
C -5.330607 -0.519389 1.035353
H 5.302562 -1.175626 0.376130
H 1.514022 -1.582423 0.816378
H 3.033289 -3.193512 -0.228919
H 4.768358 -3.511919 -0.286914
H 4.030067 -2.386506 -1.438751
H 4.362672 -1.197378 2.722482
H 4.976292 -2.788274 2.239651
H 3.238174 -2.478926 2.281235
H -3.998285 -0.972503 -2.782238
H -4.026335 0.794579 -2.646651
H 3.274920 2.866357 -0.591528
H -0.021403 0.046195 -2.099770
H -1.884829 -0.080918 -3.736945
H -2.156764 -0.205711 2.246674
H -5.879483 -0.467840 -1.045029
H 1.053386 3.796945 -0.578086
H -0.142711 2.642264 -1.188156
H -0.084761 3.025951 0.537333
H -4.494036 -0.533053 3.027987
H -6.354627 -0.660906 1.378624
H 5.636908 0.315367 -0.072732


%chk=000233479-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233479

0 1
O 5.121083 1.174421 -0.359880
N -0.364851 0.140437 0.597754
C 4.312812 -1.601647 0.582966
C 3.339475 -0.446026 0.319842
C 1.001681 0.397692 0.283259
C 1.951435 -0.624363 0.526569
C -2.724244 -0.142682 0.138321
C 3.768574 0.837591 -0.119643
C -3.788121 -0.227088 -0.805107
C 1.453334 1.690625 -0.140425
C -1.316435 0.061483 -0.315441
C 4.045064 -2.801601 -0.364672
C 4.285757 -2.044567 2.070347
C -3.535278 -0.123217 -2.300218
C 2.838377 1.880115 -0.328114
C -1.078345 0.133696 -1.771148
C -2.088732 0.041491 -2.682600
C -3.009609 -0.245786 1.527658
C -5.113229 -0.411986 -0.335631
C 0.483671 2.842861 -0.332306
C -4.327505 -0.431261 1.979915
C -5.388484 -0.514459 1.042222
H 5.354525 -1.266369 0.375258
H 1.575003 -1.588172 0.886827
H 3.035090 -3.216429 -0.193271
H 4.778905 -3.610615 -0.190216
H 4.106712 -2.494997 -1.424241
H 4.514995 -1.198727 2.742647
H 5.022589 -2.848928 2.252951
H 3.287264 -2.429981 2.345476
H -3.943741 -1.021486 -2.812097
H -4.121246 0.723473 -2.720566
H 3.223473 2.856738 -0.639864
H -0.038838 0.239120 -2.102065
H -1.860332 0.084505 -3.756092
H -2.167443 -0.174859 2.222666
H -5.933720 -0.476865 -1.061369
H 1.026306 3.794405 -0.462106
H -0.162050 2.699915 -1.219700
H -0.191511 2.941687 0.537827
H -4.535231 -0.510195 3.052641
H -6.418763 -0.657738 1.386648
H 5.707284 0.398388 -0.176120


