%chk=000261946.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261946

0 1
O 4.328468 -1.668031 -0.518545
N 0.972876 0.428686 0.877565
N -1.433337 -0.513744 -0.697003
C 0.326165 1.162413 -1.461062
C -1.167972 1.738781 0.424262
C 1.481093 0.835562 -0.475345
C -2.141308 0.594008 0.028861
C -0.521706 2.292159 -0.855565
C -0.067945 1.348909 1.435537
C -0.584404 -0.028704 -1.831855
C 2.367416 -0.310215 -1.006886
C -2.834613 -0.012535 1.268988
C 2.117223 0.303523 1.843028
C -2.428517 -1.520538 -1.201237
C 3.546422 -0.556493 -0.055228
C -3.853361 -1.079277 0.848683
C 3.051291 -0.822089 1.374340
C -3.165756 -2.150765 -0.006881
H 0.797804 1.520354 -2.409649
H -1.782706 2.539938 0.904174
H 2.114460 1.763657 -0.404424
H -2.934095 1.056717 -0.622274
H 0.098143 3.178262 -0.632471
H -1.290061 2.633385 -1.571604
H 0.370383 2.284682 1.849193
H -0.535428 0.799457 2.285934
H -1.186827 0.259798 -2.722306
H 0.050851 -0.893330 -2.133052
H 1.752851 -1.231283 -1.092306
H 2.736883 -0.084425 -2.021418
H -3.324329 0.780570 1.858228
H -2.064025 -0.472846 1.923245
H 1.701274 0.040208 2.839745
H 2.689593 1.247829 1.970007
H -1.869659 -2.311345 -1.746012
H -3.161600 -1.088242 -1.915711
H 4.289705 0.271329 -0.090060
H -4.684575 -0.615359 0.285653
H -4.308648 -1.542230 1.743430
H 3.907826 -0.927881 2.063384
H 2.505477 -1.786799 1.407510
H -2.434394 -2.705916 0.615788
H -3.900571 -2.890949 -0.368886
H 3.798735 -2.486530 -0.547474


%chk=000261946-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261946

0 1
O 4.357216 -1.747499 -0.498541
N 0.964998 0.500703 0.888996
N -1.440172 -0.472119 -0.747432
C 0.323216 1.188772 -1.469071
C -1.174133 1.765034 0.417135
C 1.463777 0.816989 -0.476187
C -2.121769 0.585094 0.049201
C -0.529314 2.328617 -0.868584
C -0.039190 1.447843 1.419251
C -0.630658 0.041957 -1.873332
C 2.333384 -0.357795 -0.981958
C -2.793830 -0.053311 1.285676
C 2.075294 0.292836 1.844017
C -2.385762 -1.518234 -1.201149
C 3.510011 -0.632910 -0.025826
C -3.796001 -1.153577 0.870997
C 2.984743 -0.872475 1.402032
C -3.085603 -2.203905 -0.012074
H 0.821205 1.537240 -2.396761
H -1.812956 2.538839 0.889934
H 2.129386 1.728714 -0.430169
H -2.945217 1.046458 -0.573136
H 0.097387 3.211788 -0.634480
H -1.305841 2.650500 -1.590227
H 0.432820 2.431337 1.696799
H -0.448210 1.021660 2.355280
H -1.284906 0.438720 -2.699637
H -0.066030 -0.807147 -2.304285
H 1.701015 -1.265717 -1.038372
H 2.720941 -0.136567 -1.994580
H -3.302329 0.737834 1.871929
H -2.008523 -0.499663 1.924391
H 1.643958 0.074427 2.839343
H 2.698197 1.223393 1.954458
H -1.818114 -2.263862 -1.790709
H -3.168984 -1.085535 -1.884541
H 4.205188 0.227565 -0.029939
H -4.630262 -0.696380 0.298403
H -4.241145 -1.631315 1.764502
H 3.833893 -0.985153 2.101450
H 2.394238 -1.810664 1.419630
H -2.325745 -2.739854 0.588566
H -3.809082 -2.952535 -0.389543
H 3.802009 -2.569403 -0.511156


