%chk=000198084.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198084

0 1
O 0.060923 0.346597 -1.953603
O 3.855783 1.734979 0.656693
O -0.874640 -3.529587 -0.425684
O 4.638063 -0.559192 0.761210
O -2.911670 3.277191 0.391611
O 1.454778 -4.117106 0.249848
O -3.363239 -3.060946 -0.016178
C 0.023580 0.478886 -0.510603
C 1.779751 2.386734 -0.356870
C 0.343084 1.931531 -0.174011
C 1.112265 -0.512207 -0.082918
C -1.385667 0.032706 -0.087205
C 2.403121 -0.063730 0.208699
C 2.785383 1.366463 0.229680
C 0.788235 -1.880341 -0.038777
C -2.394997 0.961673 0.181984
C -1.655165 -1.342968 -0.098921
C -0.639961 2.775697 0.152787
C 2.052141 3.734639 0.325588
C 2.082662 2.483644 -1.861961
C -0.591456 -2.347629 -0.239062
C -2.077145 2.403131 0.255088
C 3.402452 -1.038102 0.503553
C -3.734964 0.506090 0.410044
C 1.819120 -2.816554 0.241092
C -3.000215 -1.775862 0.066934
C 3.131899 -2.412028 0.515419
C -4.027395 -0.850572 0.334497
C -4.824651 1.466927 0.715282
H -0.461420 3.836942 0.362338
H 1.771738 3.721835 1.385483
H 3.128189 3.972727 0.291997
H 1.523030 4.559364 -0.162513
H 3.126708 2.772222 -2.039033
H 1.907408 1.524709 -2.374828
H 1.451179 3.236216 -2.346833
H -0.647178 0.902885 -2.362264
H 3.909002 -3.135091 0.727987
H -5.041547 -1.224780 0.476170
H -5.800293 0.993930 0.877647
H -4.590652 2.074495 1.609156
H -4.940371 2.215249 -0.092147
H 5.302786 -1.279548 0.955170
H 2.213856 -4.732641 0.455788
H -2.555404 -3.698780 -0.245632


%chk=000198084-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198084

0 1
O 0.003969 0.313389 -2.003850
O 3.550692 1.868153 1.261472
O -0.940076 -3.543482 -0.581251
O 4.685824 -0.551608 0.848539
O -2.903364 3.361798 0.663924
O 1.550779 -4.184143 0.091103
O -3.372579 -3.086613 -0.131188
C 0.002448 0.496941 -0.488332
C 1.797479 2.401688 -0.370537
C 0.345052 1.954213 -0.200966
C 1.096014 -0.495199 -0.062448
C -1.398377 0.069356 -0.038111
C 2.381461 -0.029332 0.315803
C 2.661870 1.431866 0.485117
C 0.782356 -1.886770 -0.120115
C -2.421190 1.003521 0.269287
C -1.679217 -1.317083 -0.132379
C -0.644527 2.815185 0.178497
C 2.045453 3.853616 0.089892
C 2.298666 2.258839 -1.851326
C -0.616223 -2.314563 -0.333462
C -2.060877 2.441912 0.382756
C 3.406502 -1.002738 0.559052
C -3.776812 0.533896 0.480362
C 1.828975 -2.826627 0.139228
C -3.035480 -1.769191 0.017362
C 3.129810 -2.377815 0.455257
C -4.052179 -0.835155 0.332945
C -4.922948 1.455459 0.841710
H -0.441301 3.875995 0.346372
H 1.743161 4.013293 1.138968
H 3.122226 4.078618 0.024751
H 1.501456 4.565075 -0.556405
H 3.361878 2.556447 -1.900857
H 2.182712 1.236002 -2.237724
H 1.714414 2.936583 -2.499338
H -0.766240 0.833912 -2.358514
H 3.930010 -3.111048 0.630026
H -5.070228 -1.214931 0.459629
H -5.856541 0.878339 0.952353
H -4.719903 2.002676 1.778547
H -5.066896 2.241995 0.081036
H 5.316325 -1.306735 0.969225
H 2.350040 -4.719040 0.334728
H -2.495506 -3.586896 -0.388440


