%chk=000180332.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180332

0 1
O 2.431879 0.639613 0.124389
O -5.335025 1.631403 0.181518
O 3.710768 2.403648 0.371561
C -0.256826 -0.450945 -0.373674
C 0.922264 -1.157537 0.307700
C -1.590364 -0.826702 0.283771
C 2.256143 -0.743193 -0.318732
C -2.764985 -0.103931 -0.389611
C -4.101281 -0.488449 0.254436
C 3.428772 -1.628529 0.131940
C -5.280420 0.288085 -0.352535
C 4.737758 -0.973545 -0.177733
C -6.633346 -0.308467 0.017980
C 3.689238 1.227643 0.104547
C 4.845015 0.358493 -0.203835
H -0.281386 -0.699172 -1.451698
H -0.099211 0.648050 -0.317794
H 0.932081 -0.899467 1.388336
H 0.800543 -2.255481 0.250095
H -1.743332 -1.921828 0.234643
H -1.563006 -0.573114 1.362004
H 2.207055 -0.687415 -1.429462
H -2.784777 -0.343397 -1.471083
H -2.613049 0.991958 -0.327063
H -4.274923 -1.576017 0.143823
H -4.069534 -0.305951 1.347474
H 3.350474 -2.625763 -0.345344
H 3.374355 -1.821376 1.227946
H -5.175247 0.391873 -1.456728
H 5.584445 -1.635604 -0.362739
H -7.440637 0.380719 -0.270255
H -6.727677 -0.452550 1.101313
H -6.807974 -1.267315 -0.476857
H 5.772671 0.889978 -0.420065
H -4.443262 2.012586 0.266332


%chk=000180332-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180332

0 1
O 2.469807 0.642080 0.231135
O -5.332507 1.689697 0.012416
O 3.813050 2.503023 0.237657
C -0.241039 -0.403673 -0.308680
C 0.936670 -1.235181 0.244466
C -1.608666 -0.877031 0.230404
C 2.304163 -0.769784 -0.265751
C -2.791516 -0.042779 -0.311233
C -4.162062 -0.513166 0.226712
C 3.483723 -1.644614 0.192450
C -5.365304 0.257381 -0.362938
C 4.799498 -0.970021 -0.131849
C -6.711811 -0.261086 0.151379
C 3.723259 1.267960 0.063940
C 4.882761 0.385614 -0.237678
H -0.243804 -0.460555 -1.417630
H -0.079358 0.658824 -0.046589
H 0.940695 -1.188721 1.351493
H 0.809261 -2.301101 -0.037112
H -1.765233 -1.944568 -0.032810
H -1.605649 -0.826221 1.338887
H 2.302060 -0.710734 -1.374899
H -2.795564 -0.088352 -1.421086
H -2.620098 1.020245 -0.036747
H -4.290543 -1.590981 -0.003923
H -4.185112 -0.411119 1.330380
H 3.419322 -2.629097 -0.308296
H 3.415931 -1.841195 1.283207
H -5.331344 0.169263 -1.474141
H 5.693565 -1.591875 -0.265731
H -7.538716 0.330100 -0.277667
H -6.758514 -0.169106 1.251147
H -6.854246 -1.321923 -0.123263
H 5.819709 0.903487 -0.462673
H -4.475191 2.083508 -0.290377


