%chk=000185749.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185749

0 1
O -2.302755 0.667745 -1.549797
O 3.059438 -0.483044 2.011992
O -1.034709 2.466892 -1.887427
O 4.410263 -2.173063 1.393569
O -4.489685 -0.948845 2.172356
C -0.166627 0.628532 -0.435292
C 1.247282 0.637322 -1.088727
C -0.155974 1.285856 0.984510
C 2.200822 0.076302 -0.094609
C -0.808464 -0.776252 -0.356932
C 2.217703 0.528487 1.349471
C 0.811150 0.540694 1.933496
C 1.328618 -0.158662 -2.414193
C -1.139228 1.400363 -1.346532
C 3.049104 -0.951361 -0.282082
C -2.274827 -0.590976 -0.796009
C 2.747115 -0.672310 -2.713864
C 3.297289 -1.587176 -1.599115
C 0.170745 2.777957 0.931330
C 3.634077 -1.336359 1.033819
C -3.233389 -0.482968 0.338702
C -4.070651 0.661968 0.622888
C -3.519790 -1.429274 1.293967
C -4.808385 0.342222 1.729441
H 1.518688 1.707326 -1.302770
H -1.191857 1.174092 1.404620
H -0.726322 -1.216548 0.652734
H -0.285021 -1.488805 -1.029339
H 2.760175 1.485434 1.506819
H 0.466475 -0.498872 2.109678
H 0.811679 1.016433 2.933796
H 0.976922 0.479811 -3.247635
H 0.634466 -1.026124 -2.379887
H -2.610558 -1.342511 -1.545892
H 3.431898 0.188005 -2.852126
H 2.746350 -1.218700 -3.676023
H 4.381570 -1.771975 -1.750422
H 2.815943 -2.587094 -1.636725
H 1.168827 2.980964 0.528142
H -0.537983 3.333099 0.298555
H 0.125226 3.229761 1.929559
H -4.084754 1.563566 0.035312
H -3.194533 -2.419213 1.521908
H -5.552414 0.817901 2.328736


%chk=000185749-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185749

0 1
O -2.342760 0.785437 -1.524376
O 3.163671 -0.551855 2.011916
O -0.820448 2.469365 -1.956965
O 4.577587 -2.273888 1.254092
O -4.407674 -0.597414 2.423116
C -0.173920 0.572748 -0.447610
C 1.272925 0.570679 -1.092442
C -0.133314 1.223352 1.003961
C 2.238716 0.007023 -0.094993
C -0.900610 -0.804853 -0.385561
C 2.252398 0.424126 1.352467
C 0.831329 0.423613 1.938683
C 1.409461 -0.170267 -2.457048
C -1.089605 1.406173 -1.372657
C 3.124138 -1.004852 -0.309866
C -2.385039 -0.501367 -0.741210
C 2.873650 -0.601475 -2.747107
C 3.412625 -1.582889 -1.669723
C 0.195694 2.737439 1.017394
C 3.740996 -1.394104 0.985648
C -3.335136 -0.335840 0.419588
C -4.537700 0.480156 0.414009
C -3.296026 -0.972706 1.650709
C -5.153312 0.302403 1.637404
H 1.498003 1.644394 -1.267595
H -1.151723 1.106965 1.425549
H -0.816015 -1.280068 0.602994
H -0.485427 -1.507839 -1.124377
H 2.723131 1.417897 1.483541
H 0.503961 -0.625984 2.053976
H 0.825191 0.878329 2.945184
H 1.036084 0.482715 -3.266481
H 0.786234 -1.085156 -2.470978
H -2.788624 -1.236328 -1.459678
H 3.524258 0.294837 -2.776370
H 2.924460 -1.071287 -3.746643
H 4.500009 -1.746776 -1.789337
H 2.940209 -2.579951 -1.779229
H 1.178561 2.971418 0.571486
H -0.556213 3.321990 0.462716
H 0.207014 3.099932 2.061475
H -4.865615 1.123729 -0.399239
H -2.626463 -1.687517 2.120546
H -6.050780 0.698295 2.103033


