%chk=000212875.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212875

0 1
O 0.509757 -0.987064 -1.019383
N 0.702998 1.042600 -0.018189
N 4.350701 0.204096 0.315327
C -1.547995 -0.050145 -0.105220
C -3.681879 -1.382644 -0.337224
C -3.740270 1.131450 -0.504218
C -3.290286 0.023259 1.717374
C -2.169663 -1.365135 -0.634461
C -2.225092 1.150461 -0.807344
C -1.772756 0.038249 1.422981
C -4.356936 -0.180873 -1.033348
C -3.907084 -1.288666 1.187655
C -3.961527 1.227277 1.021240
C -0.037542 -0.069187 -0.425285
C 2.162634 1.110407 -0.265999
C 2.944289 0.325374 0.814166
C 4.674329 -1.199612 -0.109508
C 5.336867 0.713867 1.325559
C 3.849982 -1.605777 -1.329446
C 6.668459 1.030756 0.641974
H -4.121766 -2.330173 -0.720776
H -4.224583 1.998930 -1.005577
H -3.450150 0.092415 2.816486
H -1.667564 -2.235471 -0.173183
H -1.980356 -1.463167 -1.719828
H -2.053878 1.096876 -1.898192
H -1.787413 2.106065 -0.473296
H -1.321925 0.954174 1.839968
H -1.279428 -0.811367 1.928823
H -4.226811 -0.251616 -2.127384
H -5.445123 -0.193698 -0.850366
H -4.985705 -1.324805 1.418362
H -3.453545 -2.158102 1.694518
H -3.550993 2.174452 1.410204
H -5.041859 1.243699 1.248247
H 0.294349 1.777109 0.543604
H 2.383672 0.677925 -1.273263
H 2.484861 2.170769 -0.292870
H 2.884363 0.853204 1.786041
H 2.462443 -0.665587 0.971816
H 5.755739 -1.228898 -0.374303
H 4.525476 -1.935695 0.710640
H 4.928475 1.649512 1.768779
H 5.499170 0.005138 2.166217
H 4.009157 -0.914145 -2.165620
H 4.116790 -2.611239 -1.667567
H 2.764849 -1.605158 -1.125931
H 7.340041 1.568591 1.317852
H 7.182871 0.123593 0.305056
H 6.510359 1.655178 -0.248410


%chk=000212875-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212875

0 1
O 0.468287 -1.096053 -1.041683
N 0.692388 0.953856 0.001499
N 4.401765 0.118380 0.335165
C -1.579798 -0.071901 -0.086961
C -3.769022 -1.365095 -0.276194
C -3.779928 1.156241 -0.521764
C -3.352025 0.102419 1.746709
C -2.248072 -1.389284 -0.572205
C -2.255735 1.135064 -0.819957
C -1.827166 0.080193 1.450897
C -4.424472 -0.167098 -1.014613
C -3.998011 -1.220148 1.252654
C -4.004605 1.302880 1.008156
C -0.068172 -0.127094 -0.412579
C 2.141486 1.019017 -0.269239
C 2.971704 0.167191 0.728858
C 4.824612 -1.209750 -0.182509
C 5.331542 0.693228 1.341474
C 4.115859 -1.606495 -1.492212
C 6.671733 1.159999 0.738694
H -4.221545 -2.312001 -0.630889
H -4.238873 2.015540 -1.050024
H -3.505754 0.208553 2.839082
H -1.767342 -2.250808 -0.071806
H -2.061240 -1.517037 -1.654331
H -2.080065 1.049249 -1.910375
H -1.801892 2.092988 -0.491979
H -1.368750 1.016160 1.833014
H -1.344899 -0.759962 1.988927
H -4.284022 -0.273638 -2.108984
H -5.516387 -0.150277 -0.823822
H -5.082938 -1.218030 1.480142
H -3.552263 -2.083578 1.786152
H -3.567155 2.256558 1.368477
H -5.089928 1.337689 1.229849
H 0.245855 1.709927 0.521157
H 2.323849 0.634189 -1.286053
H 2.470072 2.072992 -0.235480
H 2.862496 0.588921 1.749107
H 2.529683 -0.849597 0.753409
H 5.913677 -1.170819 -0.366349
H 4.655942 -2.009515 0.585336
H 4.829854 1.571546 1.790147
H 5.531774 -0.023008 2.180713
H 4.334906 -0.867703 -2.284267
H 4.476095 -2.596431 -1.830295
H 3.019179 -1.669903 -1.372051
H 7.285800 1.659442 1.511400
H 7.264149 0.318431 0.337523
H 6.487852 1.871774 -0.085224


