%chk=000267121.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267121

0 1
O -0.076430 -1.774940 -1.176887
O -0.329770 -3.197264 0.552819
N -3.735666 0.483331 1.002473
N 2.242018 1.997948 0.285944
C -0.186674 -0.767227 1.019598
C -1.556419 -0.184756 0.801620
C 0.941106 0.150292 0.637029
C -2.681348 -0.228089 1.625974
C 0.965911 1.543054 0.698712
C -1.938100 0.519207 -0.406196
C 2.258982 -0.289422 0.232247
C 0.083400 -1.205487 2.471686
C -3.301402 0.936822 -0.257942
C 3.054556 0.884792 0.001849
C -0.194211 -2.060097 0.156944
C -2.900093 -0.875023 2.938567
C -0.073573 2.505574 1.122150
C -1.262328 0.819047 -1.604485
C 2.860526 -1.550828 0.066587
C -3.973577 1.664517 -1.259620
C 4.397792 0.810759 -0.414369
C -5.092593 0.648945 1.535595
C 2.657851 3.400622 0.178694
C -1.925882 1.531811 -2.588763
C 4.183869 -1.620966 -0.337855
C -3.268015 1.955095 -2.414920
C 4.944142 -0.450314 -0.582111
C -0.159218 -2.879601 -2.131840
C 1.178137 -3.585772 -2.220671
H -0.026453 -0.360279 3.158249
H 1.108231 -1.585480 2.580777
H -0.592213 -2.014541 2.787248
H -2.249427 -1.766117 3.048778
H -2.664606 -0.195342 3.770344
H -3.929607 -1.232424 3.075495
H 0.331850 3.357159 1.681644
H -0.631369 2.896025 0.253584
H -0.822005 2.017218 1.769774
H -0.235219 0.466875 -1.738122
H 2.289224 -2.457729 0.260168
H -5.003475 1.974982 -1.129142
H 4.977756 1.709238 -0.591003
H -5.669163 -0.290977 1.454877
H -5.063844 0.954284 2.596351
H -5.637533 1.429746 0.976045
H 2.878601 3.824638 1.175033
H 3.566718 3.492523 -0.441536
H 1.866725 4.009434 -0.294708
H -1.419998 1.770696 -3.521313
H 4.660800 -2.589545 -0.469677
H -3.747488 2.513760 -3.216773
H 5.978845 -0.555627 -0.902866
H -0.977488 -3.553683 -1.823310
H -0.424967 -2.332330 -3.054590
H 1.222304 -4.258088 -3.083838
H 2.002419 -2.863549 -2.311635
H 1.370490 -4.185000 -1.319087


%chk=000267121-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267121

0 1
O -0.019310 -1.829809 -1.136947
O -0.470167 -3.164021 0.712491
N -3.788657 0.379145 0.909297
N 2.338644 2.064469 0.347097
C -0.143372 -0.711653 1.039231
C -1.550964 -0.131360 0.773187
C 1.000942 0.214706 0.606849
C -2.708293 -0.254041 1.568855
C 1.053016 1.613065 0.733978
C -1.949368 0.566339 -0.444917
C 2.328417 -0.221355 0.193533
C 0.127764 -1.085297 2.527347
C -3.345694 0.884677 -0.322752
C 3.132563 0.960012 0.024012
C -0.195893 -2.039383 0.223915
C -2.957346 -0.954985 2.882259
C 0.034286 2.604037 1.226438
C -1.267413 0.950700 -1.632530
C 2.942005 -1.484910 -0.023289
C -4.058221 1.580445 -1.326299
C 4.485515 0.916019 -0.377907
C -5.161960 0.477863 1.408852
C 2.808140 3.448533 0.301267
C -1.971630 1.641765 -2.636520
C 4.295281 -1.540433 -0.411927
C -3.353375 1.959056 -2.486071
C 5.060494 -0.352549 -0.597309
C -0.275257 -2.993273 -2.041250
C 0.980155 -3.853045 -2.213293
H -0.029966 -0.202371 3.170672
H 1.181160 -1.396463 2.632305
H -0.502496 -1.919649 2.868160
H -2.746170 -2.036202 2.798756
H -2.321780 -0.559381 3.692026
H -4.006217 -0.848564 3.203625
H 0.443255 3.228679 2.044301
H -0.313285 3.280636 0.421537
H -0.850551 2.077855 1.610344
H -0.214591 0.691762 -1.764740
H 2.382702 -2.415051 0.115755
H -5.122624 1.819203 -1.225088
H 5.076923 1.829494 -0.505222
H -5.640024 -0.515968 1.490727
H -5.199841 0.972567 2.396254
H -5.754464 1.082968 0.706316
H 3.587226 3.635752 1.065407
H 3.231610 3.681308 -0.693412
H 1.969264 4.136351 0.483354
H -1.451679 1.936815 -3.555089
H 4.771091 -2.514518 -0.572960
H -3.877084 2.497036 -3.284519
H 6.109639 -0.426728 -0.905176
H -1.110942 -3.582247 -1.623309
H -0.581503 -2.514945 -2.985573
H 0.794131 -4.630498 -2.978075
H 1.835095 -3.238077 -2.542611
H 1.242917 -4.356583 -1.267762


