%chk=000211019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211019

0 1
O -0.620071 -1.421152 1.492074
O 4.400766 -1.524498 -1.357002
N 1.638704 1.345198 0.938541
N -1.231892 0.786115 1.314057
C 1.920014 -0.680455 -0.063388
C 3.099676 0.114294 -0.281479
C 1.019158 0.096900 0.681195
C 2.898212 1.353874 0.367400
C -0.311975 -0.286342 1.169032
C 1.676815 -2.047684 -0.545898
C 3.782248 2.530261 0.503823
C 4.265421 -0.359761 -1.030347
C -2.626359 0.465301 1.718475
C -3.510034 0.180762 0.527047
C 5.321246 0.646279 -1.414564
C -4.441080 1.130364 0.086847
C -3.392960 -1.046866 -0.142293
C -5.253381 0.850672 -1.016896
C -4.204726 -1.320483 -1.244835
C -5.136328 -0.372540 -1.683495
H 1.232310 2.059250 1.516236
H 0.993961 -2.604510 0.119702
H 1.232954 -2.051139 -1.552928
H 2.620890 -2.622904 -0.627275
H 4.774674 2.236035 0.887800
H 3.947529 3.019712 -0.470954
H 3.395324 3.298741 1.187583
H -3.008811 1.320164 2.319952
H -2.610319 -0.421160 2.403466
H -1.161185 1.570706 0.667947
H 5.875916 1.001109 -0.538679
H 4.895625 1.512148 -1.932070
H 6.056404 0.185690 -2.093156
H -4.539722 2.083398 0.601706
H -2.661809 -1.783218 0.205581
H -5.978886 1.587759 -1.356172
H -4.113103 -2.274249 -1.762534
H -5.769506 -0.588573 -2.541798


%chk=000211019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211019

0 1
O -0.519635 -1.647573 1.532515
O 4.699514 -1.579865 -1.237429
N 1.562100 1.243117 0.671343
N -1.180541 0.556188 1.105465
C 2.127980 -0.866848 0.043802
C 3.221907 0.044659 -0.274703
C 1.108649 -0.095668 0.626594
C 2.837331 1.350895 0.149103
C -0.231425 -0.480177 1.114351
C 2.066896 -2.345298 -0.224638
C 3.527561 2.688769 0.147763
C 4.485680 -0.365728 -0.924414
C -2.553327 0.342097 1.608757
C -3.589107 0.215960 0.495072
C 5.560566 0.681118 -1.230195
C -4.665739 1.130912 0.396847
C -3.484684 -0.831035 -0.458258
C -5.624943 1.006866 -0.635902
C -4.439930 -0.955736 -1.489532
C -5.513058 -0.036378 -1.582398
H 1.079357 1.992707 1.167474
H 1.110241 -2.761942 0.126290
H 2.209082 -2.557443 -1.298957
H 2.895100 -2.865891 0.287852
H 4.486493 2.659092 0.694326
H 3.747906 3.038436 -0.876872
H 2.894389 3.456022 0.628951
H -2.824357 1.172247 2.288161
H -2.507281 -0.589503 2.201423
H -1.037781 1.344932 0.469562
H 5.937957 1.151630 -0.303249
H 5.171243 1.485923 -1.880385
H 6.397321 0.179597 -1.740483
H -4.757834 1.940541 1.132415
H -2.658856 -1.547721 -0.377507
H -6.454642 1.719941 -0.700521
H -4.353520 -1.770623 -2.217079
H -6.254915 -0.135022 -2.382844


