%chk=000299457.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299457

0 1
O -3.739424 -0.974974 -2.265858
O -2.692798 -2.820685 -0.792836
O 3.002354 -3.137094 -0.004407
O 3.264937 -1.515644 -2.012103
C -3.127737 -0.566833 0.098691
C 3.086769 -0.678780 0.294696
C -2.572679 0.518989 1.058143
C 2.508417 0.461217 1.177310
C -1.245135 1.115936 0.669031
C 1.210585 1.063717 0.704417
C -0.032781 0.556527 1.136817
C -1.199391 2.273647 -0.132337
C 1.237559 2.189588 -0.148370
C -3.299998 0.020225 -1.322683
C -2.163759 -1.780139 0.033152
C 2.573623 -2.042138 0.823130
C 2.660006 -0.517316 -1.186930
C -4.490373 -1.041621 0.629073
C 4.621661 -0.654009 0.377419
C 0.038037 2.788415 -0.541584
C -0.057243 -0.560749 2.135754
C -2.427947 3.018789 -0.554595
C 2.524948 2.776442 -0.636900
H -3.330133 1.329150 1.153439
H -2.500101 0.083463 2.081000
H 2.398418 0.098639 2.221860
H 3.268764 1.268378 1.264406
H -4.022037 0.853437 -1.340729
H -2.335926 0.351283 -1.755045
H -1.170803 -1.484251 -0.349203
H -2.059680 -2.273548 1.015794
H 2.907309 -2.236512 1.856703
H 1.465935 -2.118151 0.772350
H 1.563069 -0.563300 -1.304061
H 3.037554 0.434945 -1.615506
H -4.432146 -1.348139 1.679461
H -4.827844 -1.930337 0.073868
H -5.261437 -0.270970 0.551934
H 5.055372 -1.382491 -0.324476
H 5.025301 0.321421 0.082546
H 4.989342 -0.876249 1.382357
H 0.062905 3.673755 -1.175212
H 0.199629 -1.525106 1.663195
H 0.668866 -0.389548 2.944866
H -1.040956 -0.679408 2.616226
H -2.315475 4.098756 -0.378322
H -2.624697 2.889940 -1.628332
H -3.328237 2.702952 -0.007372
H 3.174187 3.077537 0.197140
H 3.086580 2.042953 -1.245730
H 2.375299 3.664301 -1.264435
H -4.572712 -1.393430 -1.950714
H -2.751014 -2.502631 -1.738317
H 3.985100 -3.138392 -0.076314
H 2.899738 -2.413157 -1.771508


%chk=000299457-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299457

0 1
O -3.934805 -0.961273 -2.422306
O -2.913774 -2.939533 -0.825346
O 3.814747 -3.206322 0.307021
O 2.988468 -1.863381 -1.986857
C -3.251593 -0.572530 -0.005476
C 3.173879 -0.742280 0.266560
C -2.658111 0.536429 0.952158
C 2.515894 0.352842 1.218912
C -1.274742 1.123527 0.647251
C 1.219549 1.028380 0.760274
C -0.067001 0.506136 1.121237
C -1.178009 2.351745 -0.083351
C 1.296912 2.222831 -0.015981
C -3.380147 0.008584 -1.441292
C -2.343977 -1.841331 -0.042723
C 3.187582 -2.088337 1.053409
C 2.357697 -0.931308 -1.050008
C -4.655493 -0.958266 0.531721
C 4.635689 -0.344162 -0.071181
C 0.099894 2.867700 -0.391620
C -0.122178 -0.696459 2.058111
C -2.385773 3.174164 -0.514981
C 2.618591 2.852497 -0.427879
H -3.401253 1.356499 0.967720
H -2.679398 0.106995 1.971130
H 2.357473 -0.108645 2.211909
H 3.278567 1.135415 1.380886
H -4.014735 0.916939 -1.429798
H -2.388902 0.265538 -1.850140
H -1.341350 -1.561985 -0.434005
H -2.224592 -2.249616 0.975516
H 3.699750 -1.954942 2.029560
H 2.159816 -2.440865 1.239555
H 1.327479 -1.266805 -0.798491
H 2.275851 0.021790 -1.598778
H -4.602236 -1.219656 1.604729
H -5.047065 -1.848942 0.008067
H -5.374621 -0.122581 0.425041
H 5.071416 -1.029918 -0.820328
H 4.674432 0.667635 -0.510363
H 5.269586 -0.338848 0.837350
H 0.164957 3.810585 -0.948734
H 0.168841 -1.635765 1.552010
H 0.563546 -0.563255 2.914056
H -1.125401 -0.860288 2.476150
H -2.063603 4.182164 -0.827203
H -2.920894 2.726442 -1.371815
H -3.121655 3.301289 0.300370
H 3.274377 3.057075 0.439949
H 3.189022 2.203195 -1.117844
H 2.445250 3.810615 -0.946428
H -4.907028 -1.061374 -2.263606
H -3.182777 -2.550043 -1.706650
H 4.796412 -3.078459 0.294036
H 3.205239 -2.691040 -1.470604


