%chk=000190476.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190476

0 1
O 0.053431 0.153991 0.540048
O 1.126212 1.242107 -1.120335
O -3.802372 -1.937156 -0.404133
C 3.816187 0.356660 0.240995
C 3.289548 -1.033476 -0.109266
C 2.358371 -0.025758 0.591652
C 4.771670 0.472433 1.408552
C 4.085172 1.366990 -0.842884
C 3.051232 -1.452290 -1.506793
C 1.209386 0.546077 -0.136934
C 2.083132 -2.304338 -1.884192
C -1.228010 0.554159 -0.017722
C 1.914900 -2.705949 -3.316621
C 1.098137 -2.900927 -0.929939
C -1.803259 -0.619578 -0.826443
C -2.166017 0.720610 1.180530
C -3.190628 -0.155384 1.122039
C -3.061022 -1.045602 -0.079603
C -1.873877 1.753127 2.190995
C -4.339478 -0.337070 2.055718
C -5.061450 0.887069 2.305790
C -5.671595 1.904067 2.518886
H 3.629278 -1.875700 0.517375
H 2.117024 -0.220536 1.648981
H 5.810977 0.355709 1.073256
H 4.691236 1.456580 1.888470
H 4.596385 -0.281393 2.184517
H 5.041800 1.169083 -1.340547
H 3.301999 1.365243 -1.621293
H 4.118098 2.388334 -0.443621
H 3.742726 -1.025242 -2.233643
H -1.100611 1.483895 -0.612525
H -1.070206 -1.461013 -0.882193
H -2.024760 -0.354442 -1.874499
H 0.887253 -2.526817 -3.662760
H 2.581050 -2.157738 -3.995520
H 2.123022 -3.776464 -3.453186
H 1.546525 -3.120901 0.048505
H 0.263196 -2.196076 -0.739754
H 0.658388 -3.834275 -1.301966
H -0.836322 1.665651 2.555107
H -2.541291 1.688700 3.064497
H -1.987408 2.767725 1.776918
H -5.042101 -1.108162 1.637300
H -3.972086 -0.770530 3.019710
H -6.199846 2.771907 2.698728


%chk=000190476-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190476

0 1
O -0.461534 -0.250907 0.764517
O 0.531840 0.548569 -1.200784
O -5.028455 -1.467700 0.710492
C 3.281521 0.049666 0.345254
C 2.977325 -1.294823 -0.333601
C 1.865771 -0.577755 0.539106
C 4.172525 0.005501 1.588302
C 3.460911 1.314370 -0.490938
C 2.832653 -1.457444 -1.802703
C 0.647232 -0.027922 -0.089037
C 3.228044 -2.540364 -2.537890
C -1.798135 0.193964 0.258573
C 3.020916 -2.561937 -4.043616
C 3.889062 -3.787760 -1.977521
C -2.698871 -1.012641 -0.071932
C -2.511451 0.951566 1.374770
C -3.753981 0.417707 1.615532
C -3.974379 -0.776017 0.752485
C -1.844463 2.119374 2.038298
C -4.836483 0.848943 2.588963
C -5.158165 2.288903 2.574726
C -5.445048 3.488236 2.577792
H 3.390335 -2.164205 0.191195
H 1.672365 -1.031592 1.515113
H 5.238011 0.069859 1.297193
H 3.951493 0.855332 2.261189
H 4.033769 -0.929165 2.162201
H 4.470172 1.321356 -0.943412
H 2.716464 1.401654 -1.296969
H 3.369581 2.210903 0.150755
H 2.355241 -0.624304 -2.333643
H -1.609524 0.840034 -0.620549
H -2.217070 -1.952448 0.251211
H -2.936444 -1.110151 -1.144375
H 2.384513 -3.418645 -4.343741
H 2.541461 -1.636361 -4.405445
H 3.984771 -2.682817 -4.577844
H 3.999949 -3.776182 -0.881107
H 3.305194 -4.689567 -2.249061
H 4.897738 -3.923325 -2.416569
H -0.931827 1.779214 2.564289
H -2.506517 2.627402 2.755618
H -1.512414 2.858918 1.283760
H -5.743857 0.262033 2.341397
H -4.553743 0.552299 3.619669
H -5.702499 4.531526 2.570531


