%chk=000276536.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276536

0 1
O 4.551867 -0.947676 -1.120855
N 4.058622 0.415463 0.668975
C -3.957913 0.190231 -0.069840
C -2.486085 0.046517 0.070411
C -4.518385 -1.130416 -0.124581
C 6.410766 -0.244038 0.289022
C -1.589957 1.039527 0.161978
C -2.240052 -1.423214 0.100225
C -0.137392 0.853383 0.274954
C -3.407945 -2.097783 -0.012005
C 2.643612 0.540655 0.497743
C -4.772533 1.304634 -0.151430
C 4.940247 -0.324948 -0.154942
C -5.882813 -1.315592 -0.259227
C 0.565887 1.489342 1.312640
C 0.568448 0.068839 -0.652495
C 7.060859 -1.609700 0.071546
C 7.089021 0.853148 -0.532642
C 1.944701 1.335085 1.433126
C 1.948876 -0.089769 -0.549363
C -6.162170 1.108172 -0.288134
C -6.705072 -0.173721 -0.340943
H 6.483712 0.014020 1.374596
H -1.917940 2.083950 0.159492
H -1.248714 -1.828156 0.211703
H -3.562492 -3.161745 -0.020617
H -4.363309 2.310535 -0.113003
H -6.316680 -2.310867 -0.301903
H 4.449351 0.930497 1.460070
H 0.027607 2.101668 2.036007
H 0.031218 -0.415824 -1.469599
H 6.923721 -1.955008 -0.965103
H 8.137630 -1.576800 0.269261
H 6.622733 -2.375849 0.721956
H 7.041178 0.635471 -1.609536
H 6.624233 1.832899 -0.375674
H 8.150180 0.943091 -0.271038
H 2.469875 1.827941 2.247090
H 2.487599 -0.702242 -1.281647
H -6.815580 1.976440 -0.353346
H -7.781112 -0.302362 -0.447272


%chk=000276536-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276536

0 1
O 4.749034 -1.115000 -0.991887
N 4.133593 0.540746 0.558104
C -4.043400 0.092105 0.009111
C -2.581080 -0.197848 -0.003870
C -4.726264 -1.070144 -0.485569
C 6.538763 0.063495 0.206664
C -1.614480 0.692831 0.425420
C -2.452791 -1.578751 -0.514821
C -0.153969 0.595028 0.406444
C -3.708971 -2.089649 -0.789843
C 2.715924 0.525998 0.471569
C -4.771500 1.235849 0.384701
C 5.068014 -0.235561 -0.138294
C -6.131145 -1.087471 -0.597442
C 0.593163 1.469780 1.253980
C 0.592606 -0.289112 -0.430163
C 7.212477 -1.225819 0.741265
C 7.262754 0.582537 -1.062809
C 1.994293 1.433167 1.296453
C 1.996829 -0.332010 -0.406913
C -6.186481 1.215807 0.274593
C -6.858830 0.066935 -0.211380
H 6.589963 0.846435 0.992103
H -1.991998 1.626917 0.869986
H -1.517524 -2.130958 -0.600936
H -3.926611 -3.095622 -1.156774
H -4.268473 2.136296 0.757216
H -6.655198 -1.972361 -0.976044
H 4.525330 1.213944 1.221430
H 0.055667 2.176686 1.897434
H 0.068748 -0.923853 -1.149264
H 7.132060 -2.027313 -0.013458
H 8.282133 -1.041090 0.947591
H 6.735350 -1.581370 1.672479
H 7.189113 -0.170507 -1.866661
H 6.818439 1.524634 -1.432384
H 8.330983 0.764098 -0.846580
H 2.536249 2.111977 1.967821
H 2.551069 -1.007627 -1.060669
H -6.766145 2.098508 0.567263
H -7.951896 0.074093 -0.290265


