%chk=000232217.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232217

0 1
O 0.888298 1.813093 0.161652
O 2.726604 0.880212 -0.756993
O -1.553010 -2.725645 0.083272
O -3.554020 -2.424727 -1.157529
C -0.511669 2.166680 0.096790
C -1.350643 0.961012 -0.282479
C -0.803625 2.649529 1.528917
C 1.562273 1.613545 -1.110780
C -0.926366 -0.322861 0.147119
C -2.524232 1.134352 -1.015157
C -1.734981 -1.377533 -0.200464
C -2.112196 3.423013 1.611712
C 2.488802 -0.464742 -0.250196
C 3.829472 -0.855461 0.366575
C -2.937724 -1.196886 -0.948418
C -3.355968 0.045021 -1.368167
C 2.077966 2.935023 -1.650450
C 3.797017 -2.291967 0.899686
C -2.700247 -3.421907 -0.506263
C 5.134456 -2.688121 1.520515
H -0.632088 2.991171 -0.641016
H 0.048766 3.278089 1.864247
H -0.815578 1.783954 2.220830
H 0.907197 1.041621 -1.794098
H 0.003451 -0.438008 0.713450
H -2.827075 2.132500 -1.330957
H 2.204748 -1.100372 -1.105014
H 1.667305 -0.433278 0.494133
H -2.965490 2.808451 1.297674
H -2.309055 3.747795 2.641015
H -2.098649 4.321983 0.985343
H 4.633365 -0.733562 -0.386669
H 4.083361 -0.141041 1.175873
H -4.269367 0.187995 -1.937436
H 2.430993 3.572246 -0.825220
H 1.310148 3.484161 -2.200823
H 2.938803 2.776064 -2.314700
H 3.542950 -2.994215 0.081221
H 2.990681 -2.397403 1.652589
H -3.275306 -3.875953 0.311353
H -2.320528 -4.098844 -1.282511
H 5.105814 -3.715044 1.901462
H 5.399173 -2.033654 2.359315
H 5.951073 -2.629984 0.791597


%chk=000232217-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232217

0 1
O 0.881884 2.082357 0.405078
O 2.848301 1.103134 -0.463897
O -1.766755 -2.618508 0.591270
O -3.182748 -2.570122 -1.345419
C -0.571460 2.294575 0.197014
C -1.277632 1.021030 -0.267084
C -1.087597 2.822681 1.552992
C 1.656209 1.813885 -0.835629
C -1.110476 -0.184445 0.480247
C -2.109279 1.035686 -1.412859
C -1.801394 -1.310459 0.039262
C -2.566293 3.260582 1.512602
C 2.603626 -0.248185 0.083245
C 3.960528 -0.940035 0.232962
C -2.635610 -1.284388 -1.101496
C -2.809559 -0.122860 -1.854594
C 2.095723 3.116991 -1.498743
C 3.829315 -2.359497 0.832161
C -2.789130 -3.387284 -0.166148
C 5.194208 -3.064822 0.985962
H -0.725598 3.085452 -0.571523
H -0.442572 3.672392 1.844207
H -0.942717 2.034622 2.316448
H 1.021298 1.186055 -1.505179
H -0.455673 -0.216073 1.355131
H -2.223675 1.968299 -1.977451
H 1.939548 -0.813411 -0.608493
H 2.090389 -0.156870 1.060493
H -3.229194 2.421979 1.233323
H -2.887414 3.634134 2.501414
H -2.723981 4.074751 0.779677
H 4.453622 -0.991397 -0.757387
H 4.607758 -0.316776 0.880149
H -3.447583 -0.108317 -2.741691
H 2.742211 3.676610 -0.802717
H 1.220463 3.740502 -1.753606
H 2.661499 2.907404 -2.422972
H 3.166213 -2.973276 0.188695
H 3.332140 -2.297452 1.821737
H -3.675783 -3.540669 0.477507
H -2.342328 -4.330248 -0.517149
H 5.080339 -4.075883 1.418347
H 5.865469 -2.486321 1.648161
H 5.698608 -3.169523 0.006954


