%chk=000265221.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265221

0 1
O 2.663829 2.330280 0.327463
N 0.469669 0.463806 -0.608492
N -3.278253 -2.154760 0.495280
C 1.793386 0.733622 -1.258906
C 0.644402 0.276115 0.859807
C 2.912172 -0.190574 -0.812964
C 1.581739 -0.885316 1.236542
C -0.224590 -0.697529 -1.265432
C 2.809149 -0.944403 0.370962
C 2.159408 2.220603 -1.022571
C -1.614864 -0.862005 -0.708935
C 4.068271 -0.288645 -1.600249
C -2.550545 0.299808 -0.886636
C 3.865727 -1.791455 0.743808
C -1.988392 -1.996812 -0.082986
C -3.959189 0.016204 -0.442885
C 5.114902 -1.131865 -1.221288
C 5.012181 -1.884273 -0.046913
C -4.291010 -1.204307 0.201035
C 3.001601 3.690850 0.703626
C -4.966989 0.957860 -0.657248
C -5.614699 -1.462373 0.602944
C -6.283472 0.706737 -0.249603
C -6.601033 -0.499263 0.377196
C 3.497798 3.557059 2.133158
H 1.653936 0.617614 -2.370646
H -0.353644 0.135550 1.324401
H 1.064813 1.235970 1.256671
H 1.039686 -1.850617 1.167932
H 1.873924 -0.780654 2.301529
H -0.298332 -0.473258 -2.355642
H 0.355424 -1.643770 -1.180581
H 1.267505 2.864757 -1.130053
H 2.951301 2.540011 -1.721866
H 4.156611 0.299521 -2.511580
H -2.545777 0.624581 -1.949821
H -2.144528 1.169977 -0.316142
H 3.793401 -2.375644 1.658718
H -1.317251 -2.843933 0.072094
H 6.008585 -1.200757 -1.836798
H 5.826823 -2.540635 0.252154
H -3.576091 -3.105738 0.689886
H 3.783378 4.067860 0.021578
H 2.098794 4.321128 0.626494
H -4.729002 1.901140 -1.147666
H -5.871237 -2.395816 1.094690
H -7.054331 1.452602 -0.422984
H -7.624365 -0.695772 0.693598
H 3.879576 4.507060 2.518771
H 2.698516 3.208207 2.799555
H 4.302390 2.809855 2.194995


%chk=000265221-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000265221

0 1
O 2.526192 2.416119 0.402816
N 0.526795 0.271069 -0.505439
N -3.481278 -2.271410 0.124777
C 1.814751 0.625465 -1.157383
C 0.698371 0.019897 0.953265
C 2.993762 -0.281045 -0.753967
C 1.653684 -1.165580 1.246405
C -0.219746 -0.809240 -1.222211
C 2.922676 -1.105549 0.402272
C 2.156295 2.124716 -0.984487
C -1.648864 -0.925201 -0.743296
C 4.171324 -0.290968 -1.542220
C -2.520088 0.321753 -0.812897
C 4.042515 -1.906817 0.743878
C -2.148110 -2.110158 -0.287034
C -3.967878 0.074673 -0.381317
C 5.278266 -1.094079 -1.197691
C 5.214622 -1.905811 -0.040478
C -4.401595 -1.206590 0.075370
C 2.942995 3.813327 0.582876
C -4.916887 1.119390 -0.424664
C -5.749566 -1.408202 0.474500
C -6.261267 0.928987 -0.029306
C -6.674340 -0.345691 0.423027
C 3.306602 4.003255 2.055141
H 1.656699 0.510111 -2.250654
H -0.296694 -0.173435 1.392160
H 1.107300 0.943371 1.393974
H 1.132685 -2.125889 1.048278
H 1.915063 -1.174891 2.322353
H -0.214328 -0.525783 -2.296739
H 0.279586 -1.807560 -1.154670
H 1.266006 2.723351 -1.275920
H 3.005080 2.389282 -1.656794
H 4.220833 0.334466 -2.443869
H -2.498910 0.727466 -1.849007
H -2.059986 1.119705 -0.193141
H 3.988804 -2.537855 1.640665
H -1.526270 -3.009439 -0.227550
H 6.178133 -1.091782 -1.823320
H 6.068263 -2.531895 0.243293
H -3.802972 -3.182072 0.445965
H 3.816584 4.028196 -0.073787
H 2.115530 4.496040 0.284024
H -4.591482 2.107332 -0.775288
H -6.068804 -2.399118 0.822844
H -6.972982 1.759997 -0.072911
H -7.711615 -0.513675 0.733833
H 3.645085 5.039300 2.239542
H 2.433441 3.799822 2.698991
H 4.117021 3.311243 2.341794


