%chk=000114742.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000114742

0 1
O -1.397203 -2.266477 -0.340478
O -3.614359 -1.345019 -1.463134
O -3.901096 0.911267 1.317072
C -2.439964 -1.838769 0.593297
C -1.054070 -1.245931 0.663064
C -3.542045 -1.031563 -0.077990
C -0.799703 0.131320 0.158712
C -3.326557 0.500420 0.070671
C -1.893175 0.973748 -0.034869
C 0.532569 0.618125 -0.013379
C -1.694400 2.348521 -0.305452
C 0.705563 2.019474 -0.152480
C 1.728322 -0.224533 -0.034462
C -0.417975 2.867941 -0.326228
C 3.000632 0.382687 0.122580
C 2.027699 2.604386 -0.067851
C 3.119077 1.825501 0.124507
C 1.693640 -1.624003 -0.272566
C 4.169636 -0.418095 0.207860
C 2.843016 -2.390588 -0.211312
C 4.090834 -1.789341 0.063251
H -2.755541 -2.617019 1.291770
H -0.349888 -1.608919 1.424839
H -4.555344 -1.300046 0.309576
H -3.977894 1.015876 -0.682890
H -2.560573 2.993911 -0.462280
H -2.697945 -1.491030 -1.828991
H -0.259735 3.936410 -0.476566
H -3.295969 0.717836 2.063336
H 2.109055 3.689199 -0.136435
H 4.112375 2.257483 0.247075
H 0.758262 -2.109902 -0.560825
H 5.131557 0.064669 0.375982
H 2.795032 -3.464767 -0.388457
H 4.982667 -2.409773 0.135252


%chk=000114742-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000114742

0 1
O -1.430930 -2.351130 -0.458280
O -3.485198 -1.108205 -1.690895
O -3.839361 0.685467 1.576722
C -2.513492 -1.836938 0.470513
C -1.137945 -1.264726 0.613546
C -3.571178 -0.973923 -0.237452
C -0.838061 0.122968 0.149784
C -3.375083 0.503566 0.171270
C -1.946799 0.997939 -0.006315
C 0.515554 0.606827 -0.005961
C -1.736753 2.378047 -0.270740
C 0.692953 2.034095 -0.169155
C 1.721141 -0.240413 0.010514
C -0.440200 2.889791 -0.315216
C 3.021415 0.395041 0.081142
C 2.014502 2.618179 -0.154741
C 3.134307 1.833519 0.015979
C 1.703156 -1.670335 -0.100451
C 4.207202 -0.398243 0.154987
C 2.883292 -2.427491 -0.044854
C 4.146765 -1.795310 0.112362
H -2.858943 -2.582913 1.193783
H -0.492943 -1.661114 1.407194
H -4.584420 -1.284703 0.066695
H -4.064053 1.118415 -0.430454
H -2.603605 3.035486 -0.396807
H -2.592947 -1.510755 -1.890138
H -0.271685 3.962855 -0.461498
H -3.058220 0.618821 2.183073
H 2.101045 3.705751 -0.258840
H 4.133131 2.282248 0.065118
H 0.770633 -2.200891 -0.294756
H 5.174969 0.112612 0.223963
H 2.826266 -3.517019 -0.143061
H 5.061985 -2.394520 0.165169


