%chk=000185959.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185959

0 1
O 2.220276 -0.346411 -0.604874
O -0.106693 1.074723 -0.318488
O 4.807104 1.683481 0.727879
O 4.142796 1.330409 -1.377224
C -1.407139 -0.985731 -0.102765
C 3.023809 0.121908 0.522484
C -0.185176 -0.296486 -0.260082
C -2.643167 -0.195285 -0.014797
C -2.584975 1.175794 -0.348518
C 1.038567 -1.007419 -0.308123
C -1.289673 1.766315 -0.820096
C -1.378163 -2.387440 -0.021457
C 3.804157 -1.046229 1.107578
C 2.199416 0.892849 1.535413
C 1.042576 -2.400974 -0.209502
C -3.863103 -0.743698 0.408782
C -3.731445 1.971665 -0.267316
C -0.170646 -3.084863 -0.074155
C 3.994240 1.074016 -0.214167
C -5.006695 0.055771 0.485055
C -4.943574 1.410458 0.146730
H -1.214747 1.749341 -1.926405
H -1.105545 2.790069 -0.440182
H -2.313828 -2.938146 0.082446
H 4.589204 -0.696742 1.793210
H 3.150310 -1.722518 1.672063
H 4.284607 -1.641537 0.319111
H 1.514603 1.601166 1.036313
H 2.839045 1.469338 2.218423
H 1.572206 0.231064 2.145290
H 1.987793 -2.938995 -0.269077
H -3.921605 -1.796660 0.682456
H -3.685327 3.028504 -0.525968
H -0.169613 -4.172169 -0.014758
H -5.950236 -0.379984 0.811224
H -5.836306 2.030648 0.207025
H 5.458946 2.309369 0.317572


%chk=000185959-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185959

0 1
O 2.241146 -0.281964 -0.610590
O -0.171167 1.117246 -0.407125
O 4.972891 1.618660 0.871823
O 4.195511 1.441105 -1.307618
C -1.431311 -0.990964 -0.174564
C 3.076747 0.165556 0.544671
C -0.197964 -0.285836 -0.323850
C -2.678734 -0.199530 -0.037408
C -2.651680 1.170942 -0.429655
C 1.044065 -0.979736 -0.347833
C -1.376172 1.690484 -1.058673
C -1.393351 -2.407969 -0.105285
C 3.822261 -1.043503 1.161425
C 2.243440 0.919214 1.604789
C 1.045983 -2.391149 -0.274485
C -3.877051 -0.725150 0.512518
C -3.791875 1.985338 -0.270385
C -0.169754 -3.103282 -0.158979
C 4.092324 1.119612 -0.112096
C -5.024249 0.084983 0.646974
C -4.986768 1.444167 0.257092
H -1.329119 1.431852 -2.138025
H -1.266365 2.780226 -0.946389
H -2.329695 -2.969961 -0.025245
H 4.523187 -0.701629 1.941015
H 3.090108 -1.730772 1.620571
H 4.386838 -1.588717 0.385651
H 1.666915 1.733320 1.138721
H 2.911684 1.331921 2.378060
H 1.534678 0.221767 2.085228
H 2.002577 -2.916305 -0.358014
H -3.911441 -1.764381 0.855940
H -3.751708 3.040761 -0.565720
H -0.158295 -4.197431 -0.125339
H -5.942633 -0.338244 1.068548
H -5.874040 2.075923 0.372109
H 5.625017 2.229049 0.433244


