%chk=000257623.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257623

0 1
O -4.419627 2.505420 -1.754441
O 4.421589 2.181617 1.798479
O -5.288514 -0.001498 -2.504590
O 5.183555 -0.381049 2.365651
O -2.242939 2.820471 -0.367105
O 1.980979 2.561196 0.260225
N -1.683316 -3.175585 -0.330918
N 1.334209 -3.287060 0.255111
C -2.432971 -0.885242 -0.306643
C 2.195789 -1.039004 0.266856
C -3.749237 1.357835 -1.379001
C 3.667055 1.101895 1.366704
C -4.198439 0.050029 -1.668210
C 4.061770 -0.245430 1.583766
C -2.605789 1.514365 -0.552934
C 2.521176 1.342579 0.582859
C -3.540071 -1.071162 -1.137523
C 3.328830 -1.308690 1.047944
C -1.957075 0.400129 -0.004409
C 1.790002 0.274741 0.023828
C -0.933468 -4.302147 0.257585
C 0.498344 -4.355147 -0.326501
C -1.722083 -2.045247 0.296537
C 1.396697 -2.139291 -0.337385
C -4.539525 2.683462 -3.192575
C 4.631318 2.233965 3.236859
C -5.800657 -1.311054 -2.860351
C 5.648928 -1.726598 2.647493
C -1.114002 3.088961 0.504458
C 2.688788 3.764893 0.660330
H -3.870181 -2.081805 -1.367489
H 3.610835 -2.344260 1.228594
H -1.092592 0.525838 0.640333
H 0.922545 0.501161 -0.595068
H -0.886088 -4.289403 1.369567
H -1.479617 -5.230442 -0.031954
H 0.451184 -4.338571 -1.438788
H 0.974962 -5.320855 -0.037140
H -1.252237 -1.828159 1.272849
H 0.886798 -1.863178 -1.278685
H -3.549187 2.735749 -3.648996
H -5.141206 1.873275 -3.619899
H -5.060660 3.644638 -3.254162
H 3.674685 2.249226 3.761631
H 5.246954 1.382004 3.552033
H 5.175476 3.176996 3.350871
H -6.642079 -1.047830 -3.513749
H -6.148153 -1.837321 -1.966432
H -5.041505 -1.883352 -3.401288
H 6.532939 -1.528439 3.266710
H 5.926600 -2.233117 1.718202
H 4.889603 -2.283441 3.204282
H -1.083428 4.185505 0.485819
H -0.191871 2.665151 0.084542
H -1.311512 2.718201 1.513029
H 2.111136 4.544333 0.151779
H 3.726577 3.730835 0.306410
H 2.655903 3.866111 1.748400


%chk=000257623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257623

0 1
O -4.382413 2.530935 -1.415561
O 4.111293 2.287049 1.853846
O -5.071783 0.042940 -2.504311
O 4.801762 -0.319293 2.659180
O -2.363088 2.787417 0.323587
O 2.100388 2.656544 -0.113014
N -1.642836 -3.288793 -0.287388
N 1.454828 -3.371422 -0.022994
C -2.317287 -0.946314 -0.145966
C 2.185545 -1.048109 0.052989
C -3.683683 1.370713 -1.071549
C 3.487297 1.159788 1.297600
C -4.018247 0.074147 -1.572754
C 3.807383 -0.186426 1.674401
C -2.647180 1.485297 -0.095532
C 2.536544 1.368740 0.259734
C -3.328549 -1.071648 -1.129819
C 3.143300 -1.273678 1.076410
C -1.984338 0.327896 0.378317
C 1.906892 0.272396 -0.368935
C -0.792981 -4.391605 0.196659
C 0.562014 -4.397294 -0.590873
C -1.580382 -2.134312 0.329775
C 1.439345 -2.172474 -0.548606
C -4.431365 2.898693 -2.846389
C 4.070611 2.433403 3.326830
C -5.497161 -1.273429 -2.987545
C 5.188879 -1.682260 3.040009
C -1.240006 2.969377 1.252747
C 3.129545 3.592771 -0.619303
H -3.547420 -2.073478 -1.507929
H 3.333331 -2.309529 1.369887
H -1.186569 0.406840 1.123661
H 1.168863 0.474771 -1.152326
H -0.550652 -4.331105 1.281424
H -1.312894 -5.345962 -0.001806
H 0.326519 -4.244305 -1.667646
H 1.036864 -5.386203 -0.461759
H -0.955127 -1.981585 1.237116
H 0.840076 -1.925135 -1.451227
H -3.406866 3.044795 -3.239225
H -4.960246 2.129391 -3.433268
H -4.979863 3.852508 -2.871877
H 3.021931 2.453495 3.679041
H 4.622889 1.613967 3.813430
H 4.552652 3.402358 3.527005
H -6.340809 -1.071119 -3.663961
H -5.831876 -1.915899 -2.150958
H -4.684986 -1.782236 -3.541696
H 5.986549 -1.554847 3.786515
H 5.575249 -2.242736 2.167848
H 4.338720 -2.232336 3.486699
H -1.216817 4.051161 1.451293
H -0.281623 2.657293 0.796331
H -1.410481 2.424232 2.201951
H 2.583538 4.519693 -0.852231
H 3.590265 3.186712 -1.540385
H 3.901653 3.774416 0.146048


