%chk=000256801.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256801

0 1
O -1.367485 -2.074658 1.299334
O -1.591075 2.206466 -1.460002
O -2.199360 -1.454977 -0.731418
O -1.860812 4.448535 -1.090872
O 4.023992 -4.109576 -1.223472
O 3.781452 -0.132165 0.642021
O 4.569597 -3.975439 0.866372
O 4.223314 1.963350 0.946241
N 3.782851 -3.848918 -0.055192
N 3.498700 1.055571 0.573405
C -4.159323 0.896672 0.185302
C -4.379274 2.396427 0.415078
C -3.797537 0.185710 1.495147
C -4.741404 3.156424 -0.867791
C -3.573792 -1.321109 1.308016
C -3.687025 3.048039 -1.978296
C -2.375129 -1.591086 0.448302
C -2.327239 3.408672 -1.457584
C -0.114254 -2.482240 0.858594
C -0.309833 2.048268 -0.965985
C 0.144039 -2.959522 -0.433143
C 0.109971 0.702031 -1.001589
C 0.872978 -2.424075 1.858726
C 0.499665 3.077234 -0.468655
C 1.430197 -3.406163 -0.728069
C 1.366944 0.387281 -0.510223
C 2.154431 -2.869548 1.553234
C 1.760396 2.748527 0.024757
C 2.425246 -3.363511 0.262981
C 2.184461 1.408695 0.015885
H -5.064513 0.442851 -0.260945
H -3.347968 0.743006 -0.561415
H -5.189353 2.548494 1.157612
H -3.474390 2.843591 0.874729
H -2.892475 0.646098 1.942587
H -4.605753 0.330840 2.241582
H -4.905293 4.226439 -0.618521
H -5.708723 2.786308 -1.265512
H -4.463433 -1.794117 0.834903
H -3.457866 -1.810256 2.302889
H -3.680518 2.017404 -2.405058
H -3.941957 3.726453 -2.822028
H -0.640358 -2.978309 -1.193544
H -0.558203 -0.065090 -1.408714
H 0.625278 -2.038810 2.847736
H 0.154179 4.116134 -0.465594
H 1.674539 -3.790405 -1.726308
H 1.733646 -0.646896 -0.519391
H 2.958594 -2.834158 2.299903
H 2.423675 3.525407 0.424387


%chk=000256801-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256801

0 1
O -1.623877 -2.262439 1.211466
O -1.559579 2.344859 -1.441016
O -2.237318 -1.688297 -0.988692
O -1.788612 4.601449 -0.784859
O 4.264762 -4.045178 -0.580704
O 4.094281 -0.279564 -0.209838
O 4.658698 -3.259468 1.525085
O 4.619281 1.896320 0.232451
N 3.880803 -3.503896 0.526756
N 3.792059 0.975732 -0.136008
C -4.308586 0.808306 0.161515
C -4.319969 2.267382 0.675641
C -4.118718 -0.204965 1.313224
C -4.667031 3.329737 -0.395852
C -3.916874 -1.677707 0.833293
C -3.729872 3.335318 -1.642323
C -2.556596 -1.875044 0.201654
C -2.284814 3.555510 -1.244783
C -0.256082 -2.541925 0.936031
C -0.199307 2.126212 -1.098767
C 0.184495 -3.197574 -0.238641
C 0.193957 0.774473 -1.258396
C 0.642092 -2.198302 1.972117
C 0.709093 3.116774 -0.644741
C 1.553014 -3.505170 -0.371771
C 1.508669 0.394560 -0.949203
C 2.007559 -2.507580 1.840096
C 2.029184 2.729344 -0.339198
C 2.445265 -3.156170 0.664679
C 2.411560 1.378790 -0.486646
H -5.262580 0.590039 -0.362059
H -3.502344 0.680915 -0.584530
H -5.056078 2.360188 1.500048
H -3.331108 2.501313 1.121845
H -3.257387 0.091040 1.944081
H -5.009517 -0.187637 1.970803
H -4.641913 4.334507 0.066532
H -5.699501 3.166242 -0.761584
H -4.685201 -1.926922 0.080285
H -4.013982 -2.363873 1.690946
H -3.816576 2.393111 -2.205236
H -4.028748 4.169141 -2.303490
H -0.519455 -3.461275 -1.029406
H -0.540577 0.042988 -1.608408
H 0.257373 -1.699395 2.865819
H 0.389566 4.152101 -0.527773
H 1.937329 -4.014843 -1.259142
H 1.842232 -0.640013 -1.055412
H 2.732746 -2.257711 2.618283
H 2.761984 3.458497 0.016229


