%chk=000224450.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224450

0 1
O 3.259367 0.287017 1.968814
O -0.167185 -1.904283 -1.311787
O 5.146899 0.184517 -0.893942
O 5.730273 -2.281725 0.094770
O -6.462709 -0.431989 1.028620
C 1.921419 0.032254 -0.103233
C 0.977967 1.241563 0.197901
C -0.378530 1.036822 -0.491283
C -1.039115 -0.208724 0.165622
C 3.252465 0.549627 0.555030
C 1.314000 -1.225889 0.530924
C -0.138556 -1.463165 0.060685
C 1.835128 2.473286 -0.140139
C -2.499065 -0.403089 -0.356589
C 3.269213 2.071015 0.271832
C 2.169462 -0.187575 -1.598012
C -1.269788 2.239872 -0.379616
C -3.287125 0.864466 -0.002912
C -3.126974 -1.633496 0.348585
C 4.513263 -0.182530 0.067695
C -2.568752 -0.571965 -1.880075
C -2.589579 2.148925 -0.168513
C -4.642093 -1.708085 0.172270
C -4.564861 0.826990 0.413873
C 4.933447 -1.398185 0.877416
C -5.330454 -0.424386 0.591187
H 0.783658 1.272582 1.302016
H -0.220181 0.821955 -1.584185
H -1.127433 0.004113 1.265970
H 1.344889 -1.146281 1.636389
H 1.931011 -2.113780 0.294253
H -0.578967 -2.298635 0.657417
H 1.495633 3.372583 0.397354
H 1.786298 2.716965 -1.215874
H 3.992830 2.304730 -0.534627
H 3.615844 2.628215 1.157937
H 2.674238 0.664857 -2.069175
H 2.791855 -1.068504 -1.789343
H 1.217878 -0.340462 -2.134920
H -0.779282 3.205449 -0.504161
H -2.890284 -1.609536 1.430285
H -2.666282 -2.558713 -0.052987
H -2.193087 0.309865 -2.409416
H -1.957383 -1.427822 -2.208397
H -3.594960 -0.746107 -2.219831
H -3.215115 3.042580 -0.108691
H 2.634244 0.881214 2.434815
H 0.573798 -2.513286 -1.497671
H -5.060164 -2.560502 0.745783
H -4.906489 -1.916486 -0.886379
H -5.127140 1.731264 0.654239
H 4.076119 -2.018528 1.205791
H 5.496968 -1.078971 1.779703
H 6.360487 -1.763524 -0.467221


%chk=000224450-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224450

0 1
O 3.113267 0.364008 2.045191
O -0.175248 -1.954806 -1.523052
O 5.226050 0.031172 -0.781195
O 6.080482 -2.110605 0.586785
O -6.508228 -0.457249 1.248882
C 1.966352 0.012230 -0.201331
C 1.014611 1.227881 0.055850
C -0.378004 1.034125 -0.591374
C -1.026408 -0.240596 0.031043
C 3.258172 0.541196 0.581500
C 1.322088 -1.266395 0.378664
C -0.136418 -1.500547 -0.112910
C 1.882453 2.461652 -0.289091
C -2.537610 -0.407712 -0.381087
C 3.318498 2.053054 0.185307
C 2.310950 -0.162811 -1.705159
C -1.273217 2.235805 -0.373729
C -3.275029 0.844833 0.128327
C -3.133553 -1.677335 0.294470
C 4.529134 -0.235187 0.239445
C -2.738241 -0.469848 -1.928981
C -2.586074 2.131283 -0.003701
C -4.675854 -1.733143 0.241402
C -4.558556 0.791619 0.630762
C 4.960853 -1.383350 1.147462
C -5.334443 -0.452504 0.758440
H 0.817353 1.261308 1.155034
H -0.237209 0.884544 -1.683099
H -1.047417 -0.055985 1.130516
H 1.311554 -1.197247 1.484098
H 1.925785 -2.163694 0.127420
H -0.566605 -2.305436 0.520483
H 1.529696 3.377055 0.216486
H 1.867701 2.660763 -1.376177
H 4.065743 2.192791 -0.613779
H 3.659208 2.639902 1.057185
H 2.878256 0.690960 -2.110735
H 2.941514 -1.058216 -1.853070
H 1.396906 -0.306705 -2.301752
H -0.825671 3.229854 -0.506313
H -2.816009 -1.697936 1.357988
H -2.717829 -2.579372 -0.191667
H -2.381485 0.453004 -2.419027
H -2.180315 -1.322214 -2.345264
H -3.810075 -0.571581 -2.174768
H -3.172328 3.038597 0.193736
H 2.404266 0.970822 2.373837
H 0.464249 -2.704151 -1.629137
H -5.069324 -2.584658 0.824617
H -5.021684 -1.885503 -0.801093
H -5.065520 1.708348 0.960591
H 4.110243 -2.073144 1.312475
H 5.217143 -0.956363 2.138455
H 6.392928 -1.596010 -0.210760


