%chk=000286957.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286957

0 1
O -3.100185 1.124062 0.373647
O -2.125565 3.195002 0.388773
N 1.428892 -0.832362 -2.572468
C 1.781154 0.496954 1.250661
C 2.951232 -0.323895 0.623881
C 3.253098 0.003990 -0.872607
C 1.983444 2.002767 0.945667
C 2.737370 -1.825888 0.878200
C 3.391091 1.535243 -1.079154
C 0.427458 -0.023041 0.785094
C 2.165389 2.278521 -0.546502
C 1.378697 -2.366260 0.420494
C 1.808514 0.330081 2.789644
C 0.249813 -1.372741 0.438808
C 4.572421 -0.676464 -1.298498
C -0.681886 0.838153 0.767891
C 2.208714 -0.474608 -1.798770
C -1.023309 -1.837981 0.057960
C -2.135112 -0.996027 0.014627
C -1.925672 0.349325 0.384676
C -3.501613 -1.491559 -0.411297
C -4.023119 -2.542429 0.577497
C -3.450171 -2.043396 -1.841184
C -3.114352 2.509880 0.350363
C -4.543696 2.926508 0.280156
H 3.878810 -0.022541 1.179368
H 2.861787 2.375994 1.505815
H 1.119154 2.584853 1.328668
H 2.855177 -2.014855 1.965309
H 3.543760 -2.409129 0.390235
H 3.538083 1.761561 -2.152593
H 4.304461 1.894770 -0.568395
H 2.271791 3.365624 -0.722993
H 1.254198 1.972412 -1.102383
H 1.107064 -3.238392 1.052619
H 1.470215 -2.772578 -0.611898
H 1.032036 0.942845 3.262424
H 1.613577 -0.707801 3.083559
H 2.770129 0.625159 3.217349
H 5.414861 -0.335007 -0.688188
H 4.513432 -1.767902 -1.198136
H 4.818254 -0.460888 -2.345231
H -0.562029 1.891983 1.040980
H -1.146195 -2.884064 -0.225083
H -4.214235 -0.623236 -0.401243
H -3.392626 -3.437663 0.591853
H -5.037913 -2.859571 0.316576
H -4.048600 -2.143425 1.597908
H -3.023729 -1.305644 -2.532531
H -4.449736 -2.303203 -2.202596
H -2.828827 -2.942661 -1.912661
H -4.746523 3.452848 -0.666466
H -4.787948 3.620200 1.099812
H -5.237434 2.071876 0.341064


%chk=000286957-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286957

0 1
O -3.118016 1.178838 0.058610
O -2.740191 2.621302 1.883165
N 1.592317 -1.074571 -2.651597
C 1.785444 0.626460 1.147563
C 2.971108 -0.286823 0.663880
C 3.353914 -0.139894 -0.866391
C 2.036026 2.088812 0.669267
C 2.739502 -1.747998 1.126414
C 3.545020 1.375070 -1.218302
C 0.425158 0.041205 0.704005
C 2.313447 2.217596 -0.839913
C 1.411146 -2.349629 0.611353
C 1.770267 0.672087 2.711884
C 0.249402 -1.362192 0.541709
C 4.688607 -0.893094 -1.160903
C -0.709312 0.878265 0.568042
C 2.336886 -0.673032 -1.808819
C -1.038314 -1.872277 0.247484
C -2.182422 -1.056965 0.108042
C -1.971951 0.334817 0.280175
C -3.563935 -1.604930 -0.258274
C -3.774600 -3.080655 0.149523
C -3.824425 -1.415098 -1.781039
C -3.411262 2.286605 0.887032
C -4.648986 2.979611 0.359473
H 3.877060 0.089562 1.188579
H 2.920164 2.469118 1.223416
H 1.194377 2.738601 0.970000
H 2.741461 -1.754572 2.231530
H 3.581771 -2.396407 0.822967
H 3.774965 1.468828 -2.296264
H 4.432095 1.738060 -0.659294
H 2.492534 3.277721 -1.102165
H 1.434252 1.885494 -1.425292
H 1.128210 -3.208155 1.251912
H 1.557388 -2.769558 -0.402746
H 1.035643 1.423713 3.053838
H 1.478106 -0.293609 3.157402
H 2.765238 0.956388 3.107034
H 5.465883 -0.561750 -0.447930
H 4.578959 -1.986605 -1.075813
H 5.036946 -0.667360 -2.184243
H -0.621328 1.957411 0.702834
H -1.145164 -2.955502 0.117113
H -4.313569 -0.991028 0.279144
H -3.135764 -3.762172 -0.442870
H -4.824189 -3.374595 -0.035115
H -3.554094 -3.243964 1.220167
H -3.752404 -0.351000 -2.064315
H -4.833721 -1.780325 -2.048883
H -3.082430 -1.980506 -2.374622
H -4.445519 3.400173 -0.641261
H -4.942928 3.786735 1.045584
H -5.475176 2.257196 0.247613


