%chk=000193682.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193682

0 1
O 0.248340 -0.798412 1.268561
N 3.098146 -1.668746 -1.332723
C 0.028205 -0.009128 0.061350
C 0.921407 -0.504657 -1.091839
C 2.413153 -0.486236 -0.712694
C -1.463786 -0.028450 -0.257560
C 0.431088 1.402656 0.490388
C -2.368007 0.037593 0.816084
C 0.179405 2.480684 -0.371974
C -1.954655 -0.069800 -1.567574
C 1.053906 1.631740 1.723904
C 0.288800 -2.236883 1.165235
C 4.404803 -1.925572 -0.654199
C 3.314325 -1.461352 -2.796147
C -3.743248 0.055386 0.580385
C 0.557675 3.773823 -0.003395
C -3.334532 -0.051948 -1.801651
C 1.428750 2.927963 2.089838
C -4.229841 0.010896 -0.731261
C 1.184385 4.000055 1.226866
C -0.991254 -2.833829 0.858623
C -2.047830 -3.355579 0.607773
H 0.753524 0.116792 -1.991051
H 0.615241 -1.534733 -1.378322
H 2.511989 -0.562398 0.395991
H 2.865883 0.486887 -0.995273
H -1.978146 0.061756 1.836364
H -0.321238 2.313434 -1.324552
H -1.275003 -0.118649 -2.416054
H 1.236996 0.793350 2.400193
H 1.068268 -2.544617 0.431207
H 0.625101 -2.497896 2.195517
H 4.220249 -2.149346 0.408566
H 5.128919 -1.100192 -0.714073
H 4.867601 -2.822550 -1.096129
H 3.766943 -2.370267 -3.223738
H 3.953720 -0.604032 -3.052211
H 2.339765 -1.324242 -3.289776
H -4.437062 0.104403 1.417418
H 0.359968 4.607777 -0.674169
H -3.708863 -0.087544 -2.822725
H 1.909999 3.100726 3.050610
H -5.301846 0.025839 -0.915522
H 1.476791 5.008273 1.512082
H -2.957332 -3.792677 0.388656


%chk=000193682-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193682

0 1
O 0.211903 -0.864965 1.357332
N 3.182180 -1.604435 -1.377940
C 0.020665 -0.025773 0.128460
C 0.953433 -0.513044 -1.016651
C 2.444656 -0.564730 -0.614793
C -1.473790 -0.032384 -0.264439
C 0.442725 1.395236 0.569502
C -2.423198 0.330049 0.726508
C 0.158651 2.493678 -0.282286
C -1.939343 -0.368539 -1.557893
C 1.136833 1.630293 1.780210
C 0.189540 -2.331819 1.200085
C 4.525513 -1.848379 -0.810972
C 3.252441 -1.311935 -2.825437
C -3.801374 0.345179 0.436851
C 0.570503 3.798545 0.062298
C -3.322306 -0.350688 -1.854414
C 1.543365 2.939397 2.129526
C -4.258985 0.003293 -0.859050
C 1.267382 4.027958 1.272245
C -1.125956 -2.934519 0.911426
C -2.197383 -3.507051 0.701933
H 0.811212 0.161741 -1.880173
H 0.648730 -1.525430 -1.344210
H 2.523334 -0.821159 0.458062
H 2.906502 0.447390 -0.736146
H -2.066559 0.588183 1.729393
H -0.404570 2.330587 -1.209102
H -1.236195 -0.658119 -2.345233
H 1.340535 0.786908 2.444515
H 0.922650 -2.655352 0.434118
H 0.546452 -2.690912 2.182357
H 4.434494 -2.130931 0.253103
H 5.203988 -0.959579 -0.874657
H 5.009202 -2.684593 -1.347458
H 3.772303 -2.137066 -3.344351
H 3.796603 -0.359195 -3.053163
H 2.236761 -1.233862 -3.249219
H -4.520011 0.622639 1.216431
H 0.340824 4.635737 -0.606753
H -3.665478 -0.616011 -2.861108
H 2.075571 3.106802 3.073157
H -5.330680 0.017003 -1.088518
H 1.583724 5.041413 1.544154
H -3.146144 -3.971265 0.503301


