%chk=000227890.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227890

0 1
O -2.057150 0.032111 0.725895
O -1.899831 -1.563332 -0.869771
C 4.327206 0.452257 -0.062239
C -4.168024 0.858905 -0.164523
C 2.838103 0.158607 -0.073113
C -3.507014 -0.143787 0.798454
C 4.914479 0.180260 1.327731
C 4.590211 1.894205 -0.512251
C -4.474186 0.203322 -1.512660
C -5.438926 1.433227 0.469638
C 2.335530 -0.844981 -0.917867
C 1.953112 0.875289 0.749287
C 0.091111 -0.408536 -0.116383
C 0.970516 -1.128835 -0.941267
C 0.587485 0.595284 0.729651
C -1.350129 -0.739176 -0.171126
H 4.838457 -0.231969 -0.789722
H -3.439330 1.694849 -0.330278
H -3.695188 0.083162 1.862246
H -3.762720 -1.194370 0.578454
H 4.504157 0.855823 2.086592
H 6.002241 0.311433 1.328731
H 4.703313 -0.844611 1.655107
H 4.147716 2.090827 -1.495928
H 5.664901 2.094404 -0.585825
H 4.169645 2.625942 0.186530
H -4.771633 0.944160 -2.260990
H -5.282315 -0.532381 -1.438072
H -3.594791 -0.331986 -1.903023
H -5.932921 2.135009 -0.213007
H -5.220989 1.978671 1.394033
H -6.167602 0.649756 0.705440
H 3.011273 -1.407729 -1.560178
H 2.335555 1.654502 1.406677
H 0.574970 -1.909338 -1.597464
H -0.103832 1.151026 1.368817


%chk=000227890-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227890

0 1
O -2.126585 0.117570 0.731761
O -1.884794 -1.841731 -0.526076
C 4.373109 0.368143 -0.113387
C -4.343526 1.021871 0.061969
C 2.872188 0.074236 -0.072902
C -3.599089 -0.091524 0.822747
C 4.994414 0.344392 1.309672
C 4.673100 1.715425 -0.823807
C -4.045164 0.970843 -1.452868
C -5.859926 0.894732 0.347319
C 2.341037 -1.076028 -0.712650
C 1.971696 0.939154 0.607116
C 0.074101 -0.488514 0.006041
C 0.961243 -1.358850 -0.676474
C 0.591225 0.666934 0.648997
C -1.376720 -0.830307 0.020840
H 4.855421 -0.437079 -0.703441
H -3.990852 1.995303 0.459950
H -3.827677 -0.056986 1.902576
H -3.842353 -1.089398 0.413541
H 4.560814 1.137970 1.946249
H 6.086040 0.512401 1.256983
H 4.815931 -0.624744 1.809076
H 4.257774 1.729603 -1.847359
H 5.764177 1.882517 -0.888740
H 4.234347 2.564888 -0.268243
H -4.577231 1.781629 -1.983384
H -4.370285 0.005464 -1.884470
H -2.965137 1.085772 -1.652443
H -6.418208 1.699585 -0.163702
H -6.080074 0.963413 1.429405
H -6.252917 -0.072301 -0.021048
H 3.019563 -1.755381 -1.242776
H 2.354850 1.835076 1.109772
H 0.549506 -2.246783 -1.167645
H -0.096595 1.334705 1.174996


