%chk=000222804.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222804

0 1
O -0.909688 1.294577 -1.756350
O -5.408743 0.211395 0.615341
O 6.390390 -0.621174 -0.740071
O -5.653680 -2.413725 0.229933
C -1.079522 1.185906 -0.321523
C -2.023227 -0.032268 -0.000866
C 0.299372 0.999801 0.341405
C 0.946674 -0.297800 -0.218644
C -3.356673 0.473189 -0.631773
C 2.348763 -0.562448 0.420198
C -1.402070 -1.283427 -0.639377
C -1.934256 2.426930 -0.013236
C 0.010714 -1.519370 -0.078298
C -3.388656 1.990572 -0.298865
C 1.209046 2.203494 0.063857
C -2.215799 -0.241216 1.507168
C 3.220943 0.689514 0.300717
C 2.594408 2.002863 0.679806
C 3.005494 -1.743072 -0.348514
C 2.242420 -0.901600 1.916960
C -4.571459 -0.262491 -0.120762
C 4.495346 -1.897864 -0.056827
C 4.516725 0.639646 -0.048145
C 5.247028 -0.610638 -0.335451
C -4.741852 -1.701988 -0.603283
H 0.158126 0.893700 1.444278
H 1.114531 -0.126871 -1.317182
H -3.292572 0.357291 -1.742922
H -1.366796 -1.175099 -1.740690
H -2.037385 -2.172947 -0.446965
H -1.636633 3.267826 -0.667072
H -1.804295 2.762180 1.026859
H -0.065296 -1.812230 0.988337
H 0.458253 -2.391147 -0.594198
H -4.043753 2.185278 0.571277
H -3.813400 2.558112 -1.143336
H 0.751351 3.128348 0.465537
H 1.293891 2.370418 -1.030202
H -2.734754 0.605102 1.975281
H -2.816081 -1.135568 1.715610
H -1.261971 -0.367575 2.032204
H 2.530816 2.051038 1.789518
H 3.249244 2.852946 0.392437
H 2.867394 -1.595871 -1.439220
H 2.483559 -2.687590 -0.100884
H -0.270640 0.631496 -2.093788
H 1.690564 -0.132372 2.468924
H 1.727495 -1.855061 2.079278
H 3.234441 -0.988082 2.376924
H 4.928409 -2.723083 -0.658556
H 4.669517 -2.188171 0.999569
H 5.130080 1.538730 -0.137515
H -3.800106 -2.289001 -0.543587
H -5.123434 -1.730612 -1.642814
H -6.316157 -1.782492 0.621099


%chk=000222804-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222804

0 1
O -0.995590 1.246900 -1.757037
O -5.292645 -0.074534 0.878518
O 6.481679 -0.578685 -0.958650
O -6.137086 -2.269233 -0.401122
C -1.101351 1.141766 -0.269591
C -2.029029 -0.079647 0.100894
C 0.316067 1.001781 0.340637
C 0.978493 -0.335981 -0.132975
C -3.374773 0.417999 -0.574933
C 2.426583 -0.561152 0.476107
C -1.399309 -1.368299 -0.476728
C -1.953196 2.371120 0.097392
C 0.046841 -1.569950 0.060276
C -3.423139 1.943606 -0.227149
C 1.217439 2.206743 -0.007906
C -2.236668 -0.224429 1.633578
C 3.267511 0.706900 0.232161
C 2.631998 2.036744 0.593991
C 3.078891 -1.783296 -0.244768
C 2.376887 -0.820370 2.016217
C -4.600618 -0.355352 -0.145445
C 4.607331 -1.878799 -0.061928
C 4.551399 0.661311 -0.249014
C 5.304595 -0.587124 -0.484389
C -5.039330 -1.547041 -1.002897
H 0.198730 0.971297 1.442387
H 1.162381 -0.228601 -1.230156
H -3.236562 0.294267 -1.666213
H -1.394688 -1.327243 -1.585467
H -2.001860 -2.255624 -0.201983
H -1.635769 3.244868 -0.494686
H -1.831546 2.620507 1.166676
H -0.009146 -1.828847 1.133657
H 0.486625 -2.447231 -0.448202
H -4.094994 2.108798 0.632641
H -3.825912 2.512560 -1.081440
H 0.766829 3.141334 0.375958
H 1.282632 2.310110 -1.107702
H -2.768056 0.640717 2.062905
H -2.852064 -1.116312 1.850313
H -1.284390 -0.344203 2.175257
H 2.551490 2.101898 1.700561
H 3.290561 2.866029 0.278188
H 2.860747 -1.708446 -1.329918
H 2.611703 -2.718927 0.114313
H -0.411097 0.521443 -2.094031
H 1.866195 -0.006728 2.560501
H 1.851572 -1.764572 2.243642
H 3.398454 -0.899755 2.428238
H 5.032201 -2.717591 -0.640936
H 4.862333 -2.067301 1.001088
H 5.105239 1.590233 -0.438754
H -4.181737 -2.232943 -1.158432
H -5.330338 -1.153621 -2.002673
H -6.426418 -1.729595 0.390629


