%chk=000180058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180058

0 1
O -1.849965 0.763050 0.660713
O -3.563359 -0.597147 -1.440716
O 0.700509 2.289907 0.119684
O 2.883901 0.876907 -0.188738
O 5.042941 0.992596 -0.568094
C -2.821406 -0.348639 0.875032
C -3.979415 -0.130948 -0.144802
C -2.046190 -1.669890 0.681149
C -0.636937 -1.227426 0.428891
C -0.611466 0.205179 0.422935
C -4.361161 1.344646 -0.228392
C -5.164209 -1.030600 0.199895
C 0.505776 -1.950256 0.205712
C 0.556394 0.927575 0.220908
C 1.727279 -1.252465 -0.017647
C 1.745230 0.156572 0.001534
C 2.975153 -1.938770 -0.261641
C 4.115721 -1.241088 -0.456581
C 4.143983 0.210823 -0.428259
C -0.187288 3.070873 0.965279
H -3.162258 -0.190235 1.916317
H -2.444169 -2.242832 -0.186848
H -2.127317 -2.328244 1.563477
H -3.479017 1.983325 -0.379342
H -5.039531 1.521190 -1.073346
H -4.863624 1.694809 0.678683
H -4.874567 -2.088224 0.228357
H -5.938046 -0.949509 -0.578320
H -5.623145 -0.766921 1.156630
H 0.499287 -3.038427 0.196050
H -2.808178 -0.066404 -1.774242
H 2.964722 -3.031912 -0.284349
H 5.078511 -1.719282 -0.646308
H 0.008365 2.850865 2.017638
H -1.233836 2.880142 0.702948
H 0.113415 4.093957 0.707892


%chk=000180058-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180058

0 1
O -1.842441 0.787813 0.283571
O -3.803157 -0.241274 -1.566516
O 0.741657 2.290980 -0.139581
O 3.020642 0.824951 -0.193859
O 5.319799 0.855958 -0.414807
C -2.822718 -0.308890 0.688700
C -4.118761 -0.083016 -0.129961
C -2.076840 -1.645143 0.422162
C -0.619351 -1.221852 0.321686
C -0.569299 0.193590 0.216142
C -4.699128 1.324259 0.133477
C -5.147876 -1.182658 0.181583
C 0.551316 -1.973060 0.240083
C 0.632313 0.914810 0.041284
C 1.796482 -1.297900 0.060738
C 1.822808 0.129787 -0.034544
C 3.060581 -1.992389 -0.027070
C 4.251094 -1.317366 -0.190937
C 4.311656 0.138077 -0.280112
C -0.057572 3.165166 0.746379
H -3.015925 -0.152178 1.767248
H -2.420989 -2.078856 -0.535939
H -2.259469 -2.376867 1.226877
H -3.956717 2.108338 -0.097275
H -5.585093 1.477910 -0.505753
H -5.005041 1.441906 1.189492
H -4.751996 -2.179361 -0.075395
H -6.053426 -1.012573 -0.424671
H -5.431734 -1.171577 1.249146
H 0.534181 -3.066322 0.301646
H -3.127837 0.448408 -1.802156
H 3.059342 -3.086886 0.040136
H 5.210165 -1.836442 -0.259208
H 0.216801 2.991122 1.803734
H -1.138857 2.998095 0.605799
H 0.221493 4.186636 0.450001


