%chk=000240517.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240517

0 1
O 0.740513 -1.974509 -0.797476
O 5.602761 0.297113 -0.177748
O -5.975926 -0.281851 0.998273
C 2.197372 -0.106205 0.063003
C 1.504101 -1.439427 0.337541
C 1.237976 1.032671 0.554231
C -0.870965 -0.249660 0.234798
C -0.011028 -1.497835 0.360210
C -0.063025 0.990733 -0.254766
C 3.466285 0.193413 0.916093
C -2.138559 -0.448592 -0.656514
C 2.133137 2.278727 0.540282
C 3.513690 1.745884 0.991098
C -0.918522 2.259144 -0.135296
C 2.530595 -0.025574 -1.431513
C -2.935981 0.850946 -0.498563
C -2.224506 2.104227 -0.935227
C -2.969981 -1.682572 -0.214709
C -1.753536 -0.666436 -2.128652
C 4.745327 -0.390536 0.328158
C -3.875009 -1.426772 0.986528
C -4.145646 0.909257 0.077977
C -4.802721 -0.259702 0.696562
C 4.897420 -1.882458 0.437104
H 2.084429 -2.200765 0.860891
H 0.979429 0.836887 1.627768
H -1.235234 -0.029691 1.275118
H -0.498533 -2.321128 0.898601
H 0.189778 0.843373 -1.340186
H 3.333555 -0.218209 1.942698
H 1.758672 3.065127 1.213324
H 2.190926 2.728408 -0.465469
H 4.319378 2.139554 0.339628
H 3.756420 2.074299 2.013514
H -0.354132 3.134615 -0.508254
H -1.149192 2.477474 0.924954
H 3.095143 0.880692 -1.678512
H 3.119843 -0.887510 -1.764233
H 1.610634 -0.031123 -2.037292
H -2.011254 2.065304 -2.023470
H -2.859446 3.001748 -0.794615
H -2.301443 -2.540684 -0.011469
H -3.602728 -2.013829 -1.066515
H -1.155075 0.160844 -2.529416
H -1.133392 -1.570244 -2.235368
H -2.633842 -0.778203 -2.769214
H -3.288511 -1.203700 1.898753
H -4.468434 -2.331486 1.229334
H -4.715023 1.836643 0.153093
H 4.821365 -2.236707 1.470990
H 4.137022 -2.411388 -0.154236
H 5.878672 -2.204787 0.054286


%chk=000240517-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240517

0 1
O 0.775526 -1.936924 -1.120104
O 5.686613 0.211818 0.040434
O -5.740092 -0.186205 1.715535
C 2.233352 -0.087297 -0.056570
C 1.526186 -1.440711 0.104387
C 1.246500 1.046672 0.389351
C -0.856208 -0.270217 0.059360
C 0.019385 -1.517238 0.122577
C -0.076068 1.006022 -0.401900
C 3.417758 0.195632 0.958547
C -2.217021 -0.455577 -0.737740
C 2.139777 2.303120 0.429885
C 3.479372 1.760392 1.034772
C -0.955718 2.264989 -0.222197
C 2.744462 0.068528 -1.514740
C -2.993980 0.845971 -0.476835
C -2.326089 2.118933 -0.956327
C -3.046727 -1.686785 -0.259686
C -1.959302 -0.657853 -2.261753
C 4.753689 -0.453669 0.566173
C -3.758605 -1.493621 1.094185
C -4.131021 0.893408 0.291041
C -4.655353 -0.254548 1.060596
C 4.909078 -1.952398 0.806923
H 2.077583 -2.248236 0.605025
H 0.985244 0.821253 1.450267
H -1.143928 -0.080931 1.120335
H -0.425802 -2.375331 0.645793
H 0.165369 0.915861 -1.478335
H 3.115720 -0.225168 1.940267
H 1.703671 3.108234 1.046941
H 2.299115 2.717022 -0.583088
H 4.361824 2.118382 0.477702
H 3.601622 2.084067 2.083636
H -0.425278 3.155104 -0.609592
H -1.144827 2.439559 0.857085
H 3.316044 1.002009 -1.646543
H 3.414832 -0.768715 -1.779985
H 1.911510 0.044967 -2.234858
H -2.145024 2.093504 -2.048274
H -2.962923 2.996240 -0.743937
H -2.409023 -2.589101 -0.239100
H -3.821323 -1.880789 -1.027859
H -1.324546 0.124936 -2.706957
H -1.453359 -1.624034 -2.430661
H -2.920514 -0.664849 -2.807505
H -3.023614 -1.356698 1.914836
H -4.373500 -2.371413 1.359264
H -4.666261 1.841787 0.431292
H 4.497282 -2.255610 1.786318
H 4.355975 -2.513623 0.027869
H 5.971420 -2.235370 0.740245


