%chk=000179178.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179178

0 1
O 0.418911 0.628968 0.551734
O 2.304233 1.915335 0.773057
O -4.357709 0.708734 -1.057425
N 2.146210 0.157468 -0.795065
N -0.456567 -0.239346 3.646232
C 3.557339 0.157740 -1.334268
C 4.498733 -0.410411 -0.266951
C 3.568473 -0.775612 -2.556825
C 3.901618 1.590657 -1.754471
C 5.732770 0.189327 0.013650
C 4.135530 -1.578223 0.424948
C 1.742601 0.994688 0.220586
C 6.587767 -0.364766 0.972913
C 4.988331 -2.128603 1.383998
C 6.218552 -1.522913 1.660728
C -0.209869 1.402259 1.614131
C -1.561029 1.843018 1.090057
C -2.306960 0.981519 0.277697
C -2.046915 3.111126 1.430691
C -3.552838 1.424122 -0.177326
C -3.297667 3.527538 0.954821
C -4.067515 2.690629 0.149274
C -0.349395 0.483797 2.753951
C -4.314883 -0.690321 -1.061670
C -4.200157 -1.458233 0.101397
C -4.507667 -1.256227 -2.330198
C -4.278601 -2.848484 -0.022018
C -4.589143 -2.646428 -2.421407
C -4.470539 -3.441718 -1.274432
H 2.897783 -0.424850 -3.349982
H 4.578369 -0.824027 -2.986845
H 3.288701 -1.805271 -2.305411
H 4.881906 1.649214 -2.238070
H 3.910645 2.272935 -0.886766
H 3.164875 1.992640 -2.460780
H 1.499536 -0.557747 -1.128582
H 6.041943 1.096789 -0.503545
H 3.180694 -2.061843 0.224914
H 7.542280 0.114226 1.185536
H 4.692418 -3.029218 1.919963
H 0.456299 2.271778 1.885939
H 6.881876 -1.950438 2.410263
H -1.907763 0.006315 -0.003535
H -1.461991 3.778944 2.060629
H -3.673580 4.516618 1.220617
H -5.041813 2.993618 -0.229992
H -4.067405 -0.989941 1.074305
H -4.597357 -0.616158 -3.204816
H -4.192705 -3.471703 0.868717
H -4.743507 -3.114335 -3.393694
H -4.531517 -4.524785 -1.357872


%chk=000179178-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179178

0 1
O 0.724331 -0.428531 0.073748
O 2.178512 1.196773 1.004611
O -4.642079 0.712148 -1.220129
N 2.724862 -0.045435 -0.928291
N -1.152071 -2.383306 2.141588
C 4.094805 0.493132 -1.189683
C 5.049840 0.105680 -0.032304
C 4.580878 -0.204526 -2.491386
C 4.004516 2.022607 -1.422645
C 6.087187 0.965973 0.403885
C 4.943046 -1.177016 0.565381
C 1.937025 0.336361 0.121232
C 6.991485 0.556994 1.410829
C 5.842631 -1.588286 1.571312
C 6.875660 -0.722020 1.998274
C -0.258218 -0.075053 1.150928
C -1.355755 0.825994 0.599536
C -2.511354 0.280690 -0.007329
C -1.174770 2.229088 0.670327
C -3.488296 1.153872 -0.535238
C -2.155734 3.085964 0.123222
C -3.316694 2.556074 -0.477016
C -0.751241 -1.355864 1.688903
C -5.232214 -0.554554 -0.953261
C -5.355147 -1.081656 0.353122
C -5.793381 -1.217289 -2.065816
C -6.037558 -2.305320 0.533929
C -6.479851 -2.435465 -1.867754
C -6.600273 -2.986966 -0.570434
H 3.922482 0.051184 -3.342863
H 5.603732 0.128558 -2.731959
H 4.606963 -1.302855 -2.369593
H 4.975151 2.429020 -1.754946
H 3.692102 2.541749 -0.502186
H 3.263399 2.228459 -2.214796
H 2.337756 -0.745880 -1.563278
H 6.191262 1.968027 -0.023602
H 4.136796 -1.852866 0.256551
H 7.781952 1.241440 1.739249
H 5.735237 -2.580093 2.024813
H 0.309623 0.463032 1.936837
H 7.574215 -1.037057 2.781354
H -2.643153 -0.804349 -0.071454
H -0.271489 2.637496 1.136304
H -2.021617 4.171525 0.172794
H -4.092229 3.201217 -0.900203
H -4.936176 -0.548449 1.212042
H -5.687743 -0.771535 -3.059366
H -6.130769 -2.721306 1.542898
H -6.916553 -2.954151 -2.728186
H -7.127782 -3.934829 -0.421146


