%chk=000193544.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193544

0 1
O 5.198278 0.620849 -0.168374
O 6.006431 -1.209744 0.882430
N -6.749999 1.518083 0.595349
C -0.490813 0.373902 0.320303
C -1.175249 -0.879236 -0.301202
C -2.598326 -0.945650 0.251455
C 0.939131 0.561579 -0.294032
C -3.419682 0.318699 -0.186588
C -1.338024 1.663107 0.202610
C -2.825411 1.509441 0.573454
C -0.374334 -2.140356 0.070985
C 1.697257 -0.764387 -0.263911
C -3.544054 -2.124719 -0.077307
C 1.686379 1.617725 0.567148
C -4.837133 -0.155460 0.178502
C 1.098253 -1.953499 -0.111960
C 0.861438 1.020773 -1.761849
C -3.430350 0.586275 -1.699845
C 3.183577 -0.697744 -0.494565
C 3.173251 1.741547 0.230429
C -4.903409 -1.503781 0.170525
C 3.845235 0.376661 0.369129
C -5.896292 0.759375 0.406998
C 6.203948 -0.252527 0.171162
C 7.474849 0.192482 -0.465877
H -0.357128 0.163415 1.411671
H -1.192124 -0.782300 -1.411417
H -2.516736 -0.923100 1.372200
H -1.269501 2.055494 -0.834219
H -0.892922 2.444962 0.848115
H -2.941376 1.369296 1.664350
H -3.369153 2.442579 0.334903
H -0.726432 -2.996028 -0.539461
H -0.568843 -2.427328 1.126592
H -3.356446 -3.004158 0.558626
H -3.443983 -2.464073 -1.123989
H 1.574461 1.357939 1.638764
H 1.203476 2.605691 0.441328
H 1.672222 -2.880535 -0.102301
H 1.857007 1.229276 -2.168645
H 0.404360 0.249738 -2.392599
H 0.264402 1.933979 -1.867928
H -2.434414 0.853262 -2.072360
H -3.766621 -0.289010 -2.265639
H -4.104816 1.415035 -1.944578
H 3.671187 -1.676063 -0.293772
H 3.377318 -0.488293 -1.568662
H 3.315886 2.128066 -0.799110
H 3.663499 2.480035 0.892829
H -5.773470 -2.119526 0.330606
H 3.953540 0.050447 1.425412
H 7.749779 1.210598 -0.148590
H 7.388047 0.219255 -1.563198
H 8.303329 -0.483347 -0.203797


%chk=000193544-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000193544

0 1
O 5.329208 0.612520 -0.138896
O 5.950242 -1.266318 1.103325
N -6.846642 1.406415 0.884026
C -0.496185 0.419946 0.185995
C -1.186502 -0.868180 -0.377712
C -2.602865 -0.952973 0.212002
C 0.942107 0.631022 -0.426149
C -3.486343 0.289973 -0.132595
C -1.388229 1.698198 0.092591
C -2.855416 1.509762 0.575513
C -0.352360 -2.114221 -0.000241
C 1.724724 -0.699449 -0.407749
C -3.531142 -2.171377 -0.047356
C 1.714370 1.665452 0.467240
C -4.855007 -0.226118 0.369685
C 1.132422 -1.906019 -0.196738
C 0.873433 1.155895 -1.894532
C -3.647450 0.553430 -1.661038
C 3.228805 -0.617698 -0.654714
C 3.221909 1.789338 0.144933
C -4.882885 -1.596806 0.360625
C 3.896459 0.421513 0.267825
C -5.956585 0.638446 0.651796
C 6.257487 -0.311783 0.352525
C 7.645564 0.018227 -0.154395
H -0.342523 0.215318 1.271174
H -1.239035 -0.805934 -1.483691
H -2.477178 -0.920983 1.318751
H -1.406357 2.068001 -0.948695
H -0.928350 2.504167 0.694919
H -2.874291 1.345606 1.671541
H -3.429834 2.435278 0.375051
H -0.686744 -2.988033 -0.595977
H -0.550652 -2.384887 1.061414
H -3.254588 -3.067977 0.536063
H -3.545413 -2.475266 -1.116406
H 1.599623 1.364258 1.529377
H 1.245338 2.661935 0.364380
H 1.764899 -2.805599 -0.166756
H 1.864650 1.127612 -2.378679
H 0.194831 0.535453 -2.507187
H 0.520009 2.202150 -1.934374
H -2.699038 0.853822 -2.136837
H -4.022848 -0.342490 -2.187352
H -4.377295 1.367825 -1.824376
H 3.691118 -1.608192 -0.500812
H 3.436971 -0.313144 -1.701191
H 3.373821 2.175952 -0.880656
H 3.699013 2.508670 0.836019
H -5.764587 -2.205025 0.585652
H 3.887072 0.056548 1.312993
H 7.926286 1.043143 0.143768
H 7.664903 -0.018208 -1.257580
H 8.370579 -0.700497 0.253600


