%chk=000192213.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000192213

0 1
O -5.777711 0.278439 -0.019522
O 6.208490 0.005249 0.785081
N 4.190973 -0.908917 0.374752
C -0.132500 -0.518869 0.280386
C 0.726350 0.629812 -0.307834
C 2.192077 0.525291 0.173387
C -1.595296 -0.463568 -0.283021
C 2.805895 -0.860458 -0.186840
C 0.508312 -1.899345 0.043151
C 1.966962 -1.963468 0.503149
C 0.122574 1.981269 0.129458
C -2.146586 0.955292 -0.174610
C -2.462504 -1.432163 0.568323
C 3.095427 1.638938 -0.381039
C -1.365508 2.030366 -0.005359
C -1.640388 -0.864107 -1.769468
C -3.631185 1.121679 -0.346924
C -3.960121 -1.317647 0.282564
C 2.895568 -1.110407 -1.702886
C -4.431256 0.125229 0.502809
C 4.475393 1.585569 0.276310
C 5.039444 0.195945 0.477397
C -6.819685 -0.178492 0.857574
H -0.194587 -0.355242 1.385608
H 0.699647 0.568357 -1.421504
H 2.189238 0.608286 1.291562
H 0.446788 -2.167995 -1.031378
H -0.074798 -2.675206 0.577521
H 2.026623 -1.847279 1.603316
H 2.383083 -2.964423 0.285202
H 0.575539 2.800315 -0.466248
H 0.388516 2.195942 1.187071
H -2.279275 -1.234055 1.642893
H -2.134620 -2.474023 0.390153
H 2.643440 2.634095 -0.204173
H 3.189420 1.546734 -1.480975
H -1.786353 3.033908 0.055713
H -1.055147 -0.170121 -2.383147
H -1.244992 -1.871879 -1.932449
H -2.667818 -0.851697 -2.152291
H -3.962189 2.152024 -0.107091
H -3.899817 0.982285 -1.418214
H 4.614161 -1.830391 0.489733
H -4.188597 -1.623173 -0.757884
H -4.527791 -2.012667 0.926839
H 3.546159 -0.378076 -2.195337
H 3.302082 -2.102517 -1.925513
H 1.909627 -1.045436 -2.177067
H -4.416539 0.401361 1.577241
H 4.449233 2.077787 1.273692
H 5.210061 2.175826 -0.312388
H -6.795954 0.368281 1.804653
H -6.742695 -1.256931 1.020396
H -7.730569 0.062473 0.295127


%chk=000192213-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000192213

0 1
O -5.902028 0.388742 0.102812
O 6.275386 -0.004694 0.974787
N 4.210982 -0.884780 0.404159
C -0.137558 -0.522830 0.173722
C 0.740898 0.644186 -0.378479
C 2.206750 0.533972 0.133296
C -1.618686 -0.477545 -0.367356
C 2.850152 -0.846487 -0.203886
C 0.528758 -1.909705 -0.036542
C 1.988499 -1.950543 0.463307
C 0.124108 2.001274 0.045637
C -2.177678 0.955241 -0.279704
C -2.505922 -1.398338 0.542098
C 3.143784 1.677293 -0.321183
C -1.382745 2.038928 -0.073835
C -1.706019 -0.961938 -1.848392
C -3.682832 1.120966 -0.450424
C -4.025420 -1.276152 0.280946
C 2.995413 -1.111371 -1.730324
C -4.488805 0.182433 0.466453
C 4.502338 1.589877 0.412764
C 5.075730 0.180097 0.598717
C -6.847688 -0.200089 1.048769
H -0.204455 -0.355795 1.274039
H 0.740136 0.601947 -1.487697
H 2.156473 0.576833 1.245887
H 0.506669 -2.185772 -1.107019
H -0.049295 -2.687211 0.496968
H 2.020096 -1.798535 1.560870
H 2.427840 -2.948693 0.257913
H 0.550181 2.821829 -0.565207
H 0.418429 2.227768 1.095437
H -2.304290 -1.138772 1.602682
H -2.202411 -2.454097 0.408109
H 2.689962 2.661439 -0.108669
H 3.291632 1.632722 -1.417549
H -1.852615 3.030916 0.003218
H -0.951715 -0.454511 -2.476314
H -1.550632 -2.053238 -1.930663
H -2.694502 -0.739417 -2.284858
H -3.980178 2.167059 -0.257277
H -3.992250 0.891268 -1.491027
H 4.634734 -1.808892 0.544483
H -4.276344 -1.596169 -0.748857
H -4.567654 -1.950852 0.971234
H 3.675704 -0.378945 -2.197260
H 3.427992 -2.116028 -1.894580
H 2.029596 -1.070912 -2.261922
H -4.339993 0.478904 1.532473
H 4.408064 2.010982 1.433709
H 5.281315 2.189095 -0.090912
H -6.649630 0.144531 2.086956
H -6.827771 -1.309344 1.031041
H -7.845904 0.145558 0.735351


