%chk=000221730.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221730

0 1
O -0.434914 -0.755000 -0.170912
O -0.531945 1.334574 -1.231791
C -2.616335 0.381709 -0.321494
C -4.093476 0.144557 -0.702771
C -2.445198 1.065091 1.053406
C -1.855805 -0.969138 -0.302877
C -1.958712 1.251856 -1.424431
C -4.860071 -0.727615 0.299170
C 0.130575 0.059541 -1.211035
C -3.188016 2.388549 1.200893
C -6.327801 -0.898811 -0.119602
C 1.550425 0.349975 -0.823375
C -7.097907 -1.767435 0.872269
C 2.386204 -0.603433 -0.400563
C 3.787353 -0.352471 -0.024017
C 4.603630 0.497884 -0.787640
C 4.318623 -0.986231 1.113163
C 5.933569 0.712072 -0.415559
C 5.646444 -0.762779 1.482496
C 6.456817 0.084800 0.719018
H -4.150288 -0.315559 -1.708662
H -4.601412 1.125889 -0.796092
H -1.353343 1.229129 1.208776
H -2.761311 0.370839 1.855195
H -2.078374 -1.571682 0.595730
H -2.046245 -1.568223 -1.208383
H -2.158924 0.869629 -2.438705
H -2.259176 2.313745 -1.356329
H -4.381812 -1.720955 0.390800
H -4.810617 -0.275405 1.309618
H 0.002874 -0.443766 -2.191159
H -2.872022 3.116889 0.444270
H -4.272738 2.262750 1.113798
H -2.987369 2.837348 2.181245
H -6.382947 -1.348165 -1.130364
H -6.814346 0.092830 -0.202754
H 1.824595 1.405409 -0.897599
H -6.667205 -2.772177 0.950331
H -8.144483 -1.882707 0.568319
H -7.095550 -1.331715 1.878076
H 2.051283 -1.641195 -0.292138
H 4.201015 0.986751 -1.673015
H 3.690180 -1.644186 1.711302
H 6.562768 1.370948 -1.011678
H 6.052194 -1.250252 2.367456
H 7.491692 0.254935 1.008114


%chk=000221730-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221730

0 1
O -0.379988 -0.750074 -0.087129
O -0.517470 1.392015 -1.210852
C -2.620322 0.369040 -0.286042
C -4.099116 0.096953 -0.690368
C -2.478063 1.074462 1.096334
C -1.832404 -0.973201 -0.253345
C -1.970745 1.220663 -1.414521
C -4.945061 -0.719701 0.314793
C 0.136171 0.073666 -1.174020
C -3.230243 2.414277 1.248463
C -6.388612 -0.951374 -0.189165
C 1.611122 0.298976 -1.004748
C -7.252830 -1.751723 0.808596
C 2.384533 -0.392460 -0.124473
C 3.836698 -0.233271 0.090752
C 4.634481 0.710812 -0.618663
C 4.478487 -1.060335 1.055543
C 6.017049 0.818723 -0.371224
C 5.863522 -0.953325 1.305191
C 6.640763 -0.012476 0.591728
H -4.108608 -0.430426 -1.669129
H -4.603864 1.069446 -0.866711
H -1.400371 1.237234 1.279807
H -2.823460 0.374313 1.883349
H -2.116797 -1.597994 0.608434
H -2.011404 -1.543099 -1.194443
H -2.149026 0.731990 -2.400797
H -2.379568 2.243246 -1.446982
H -4.471465 -1.703805 0.507758
H -4.985491 -0.194899 1.289961
H -0.106974 -0.440905 -2.141527
H -2.874339 3.170829 0.525460
H -4.321695 2.298845 1.112060
H -3.064868 2.829956 2.259194
H -6.354805 -1.483689 -1.161956
H -6.864916 0.030363 -0.389557
H 2.018021 1.075928 -1.662624
H -6.813902 -2.748506 1.003407
H -8.278271 -1.903877 0.424804
H -7.329849 -1.224794 1.778400
H 1.881299 -1.143952 0.498001
H 4.171058 1.365645 -1.364942
H 3.878573 -1.790912 1.612405
H 6.613470 1.551699 -0.926479
H 6.334948 -1.600277 2.053549
H 7.716233 0.074793 0.782209


