%chk=000235945.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235945

0 1
O 3.601747 0.380702 0.952340
C -1.673989 -0.086381 0.144234
C -0.293610 0.284025 -0.501244
C -0.157001 1.829757 -0.349021
C -2.548799 1.163424 -0.187060
C -1.609168 2.364927 -0.367239
C -2.302647 -1.352219 -0.524121
C 0.912842 -0.499721 0.027197
C -1.568990 -0.249523 1.665627
C 0.579933 2.282319 0.912651
C 2.177135 -0.247666 -0.805869
C -1.562715 -2.652855 -0.185887
C -3.786381 -1.518206 -0.157131
C 3.441240 -0.661519 -0.041576
C 4.680311 -0.723960 -0.932258
H -0.380233 0.073745 -1.596538
H 0.396775 2.224110 -1.231871
H -3.287558 1.350308 0.607833
H -3.130064 1.000030 -1.110688
H -1.818458 2.886481 -1.315337
H -1.770417 3.110966 0.428622
H -2.238951 -1.203957 -1.632410
H 1.111353 -0.235076 1.086320
H 0.677495 -1.587330 0.026252
H -1.108236 0.643013 2.116359
H -2.553428 -0.386314 2.123109
H -0.955568 -1.111060 1.944345
H 0.617551 3.372700 0.984603
H 0.086606 1.898911 1.817399
H 1.618127 1.915456 0.929765
H 2.117958 -0.781876 -1.770490
H 2.258587 0.831802 -1.055238
H -1.710679 -2.942037 0.860087
H -1.917872 -3.480289 -0.808002
H -0.478044 -2.555576 -0.349654
H -3.927867 -1.566818 0.928057
H -4.195354 -2.441167 -0.581857
H -4.397006 -0.691376 -0.532276
H 3.301089 -1.617745 0.510689
H 4.892512 0.254165 -1.383226
H 5.571773 -1.024369 -0.372598
H 4.553156 -1.440551 -1.751111
H 4.463349 0.309753 1.395816


%chk=000235945-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235945

0 1
O 3.732225 0.261690 1.050091
C -1.731817 -0.071429 0.142141
C -0.306370 0.350643 -0.401914
C -0.253016 1.940558 -0.360864
C -2.604928 1.152637 -0.291075
C -1.720249 2.397521 -0.072371
C -2.286068 -1.369447 -0.561249
C 0.924768 -0.334619 0.245449
C -1.730519 -0.199166 1.688386
C 0.725537 2.584658 0.651034
C 2.164035 -0.308735 -0.680629
C -1.415269 -2.642140 -0.409079
C -3.741787 -1.702371 -0.138798
C 3.453349 -0.768381 0.017723
C 4.644563 -0.908636 -0.946638
H -0.308018 0.064856 -1.478792
H 0.040491 2.294466 -1.369841
H -3.556589 1.213429 0.267934
H -2.860431 1.050377 -1.366099
H -2.027624 3.248279 -0.708446
H -1.798320 2.740255 0.977790
H -2.310596 -1.125236 -1.647067
H 1.187179 0.153267 1.199719
H 0.697507 -1.388598 0.489793
H -1.332691 0.717024 2.160600
H -2.753339 -0.355128 2.077159
H -1.106451 -1.042739 2.034362
H 0.652626 3.687233 0.581983
H 0.473273 2.303552 1.691259
H 1.779004 2.303237 0.478446
H 1.983618 -0.959767 -1.560622
H 2.336655 0.714869 -1.066856
H -1.248155 -2.900162 0.653764
H -1.926241 -3.503588 -0.880009
H -0.431165 -2.534926 -0.897727
H -3.790137 -2.035153 0.914938
H -4.140053 -2.525654 -0.761540
H -4.417450 -0.836767 -0.255573
H 3.266463 -1.745319 0.520329
H 4.850500 0.057224 -1.442602
H 5.562416 -1.226492 -0.414648
H 4.433073 -1.663788 -1.726505
H 4.576506 0.031470 1.514648


