%chk=000198222.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198222

0 1
O -2.665692 1.616655 -0.529075
O -4.177596 -1.502024 0.170552
O 5.072731 -0.454222 -1.197575
C -0.819451 1.056271 0.919137
C -2.008873 -0.680091 -0.666750
C -1.477857 0.761067 -0.444133
C 0.064431 -0.095659 1.446934
C -1.203783 -1.779459 0.032931
C -0.766359 -1.393016 1.445106
C 0.004765 2.352237 0.852569
C 1.383328 -0.206780 0.713310
C -3.455980 -0.590341 -0.131224
C -2.113544 -0.978858 -2.168590
C 1.218580 2.222087 -0.071992
C -3.820712 0.888791 -0.061480
C 1.930174 0.901115 0.027679
C 2.110776 -1.404699 0.766113
C 3.172858 0.788620 -0.608707
C 3.351144 -1.539221 0.140122
C 3.861730 -0.428876 -0.544089
H -1.648137 1.215543 1.656281
H -0.858202 1.117206 -1.292025
H 0.322638 0.143594 2.514908
H -0.306232 -2.016989 -0.575998
H -1.809194 -2.709666 0.064883
H -1.652235 -1.266428 2.098212
H -0.186598 -2.222171 1.896252
H 0.337937 2.626582 1.872421
H -0.641846 3.185009 0.508507
H -1.121348 -1.041340 -2.631989
H -2.620971 -1.934279 -2.353220
H -2.670877 -0.196387 -2.700348
H 1.929473 3.049161 0.139351
H 0.903449 2.373200 -1.128654
H -4.640628 1.169813 -0.743804
H -4.055562 1.223506 0.962253
H 1.703525 -2.259988 1.309825
H 3.616567 1.622349 -1.147905
H 3.897475 -2.473507 0.188652
H 5.519896 -1.330607 -1.115139


%chk=000198222-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198222

0 1
O -2.576235 1.642606 -0.765164
O -4.240721 -1.357498 0.370226
O 5.219597 -0.344860 -1.187125
C -0.826975 1.016460 0.902921
C -2.046813 -0.708945 -0.646399
C -1.425825 0.706411 -0.491717
C 0.060396 -0.140386 1.442325
C -1.282773 -1.847206 0.067145
C -0.774263 -1.448298 1.468151
C -0.028287 2.339115 0.899319
C 1.402573 -0.223017 0.694912
C -3.466502 -0.482367 -0.079679
C -2.236729 -1.044585 -2.158404
C 1.206725 2.256676 -0.025249
C -3.774343 1.020614 -0.184565
C 1.955878 0.926405 0.050892
C 2.164604 -1.418659 0.696629
C 3.227167 0.843617 -0.564136
C 3.431357 -1.504388 0.083963
C 3.962468 -0.357619 -0.551789
H -1.676786 1.124358 1.609704
H -0.700321 0.914701 -1.294652
H 0.294581 0.116915 2.499165
H -0.426016 -2.148548 -0.565801
H -1.959025 -2.720215 0.144947
H -1.638786 -1.286916 2.143245
H -0.199961 -2.284913 1.907389
H 0.296844 2.551430 1.937115
H -0.679814 3.173358 0.580262
H -1.246213 -1.186097 -2.628183
H -2.817105 -1.976590 -2.279203
H -2.756589 -0.228687 -2.690859
H 1.903239 3.084138 0.209580
H 0.896338 2.425972 -1.076783
H -4.635181 1.216642 -0.848414
H -4.008353 1.427237 0.821797
H 1.767987 -2.310749 1.192764
H 3.662919 1.718279 -1.059636
H 3.994518 -2.446477 0.105418
H 5.656226 -1.229713 -1.116809


