%chk=000229676.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229676

0 1
O -2.824590 0.722250 -1.450549
C -2.102713 -0.191141 -0.576455
C -0.247069 1.544707 0.184895
C -1.536643 0.740683 0.508327
C -3.160492 -1.196215 -0.003823
C 0.990523 0.645030 0.172996
C -1.063561 -0.931486 -1.417692
C -0.029988 2.576082 1.318716
C -0.439909 2.303005 -1.137952
C -4.318125 -0.456797 0.673248
C -2.522976 -2.207327 0.952337
C 1.158527 -0.325798 1.176234
C 2.003233 0.787936 -0.785997
C 2.289539 -1.140672 1.210152
C 3.139379 -0.025252 -0.758501
C 3.292250 -0.999732 0.237633
C 4.512624 -1.861915 0.276650
H -2.339367 1.475174 0.744507
H -1.381289 0.154965 1.436141
H -3.580253 -1.758406 -0.875845
H -1.511422 -1.658693 -2.098654
H -0.341189 -1.465431 -0.787117
H -0.483136 -0.218015 -2.023511
H 0.039163 2.096548 2.299389
H 0.899555 3.135391 1.165272
H -0.846437 3.303753 1.358110
H -0.476279 1.611085 -1.991209
H -1.406478 2.825512 -1.146201
H 0.344789 3.041499 -1.315073
H -4.652522 0.388606 0.054559
H -5.174975 -1.118759 0.830832
H -4.033672 -0.051127 1.649482
H -2.032837 -1.712486 1.799153
H -3.277908 -2.886132 1.365152
H -1.768936 -2.822310 0.449051
H -3.185968 0.260381 -2.224086
H 0.391648 -0.447552 1.941877
H 1.920001 1.541813 -1.567956
H 2.395717 -1.884737 1.996129
H 3.910076 0.104323 -1.515139
H 4.935063 -2.030664 -0.722451
H 5.298561 -1.392785 0.886844
H 4.310786 -2.849710 0.710725


%chk=000229676-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229676

0 1
O -2.738221 0.651260 -1.637011
C -2.118475 -0.253552 -0.615083
C -0.236610 1.539882 0.201104
C -1.542172 0.704354 0.461200
C -3.276947 -1.144312 -0.023691
C 1.035994 0.657935 0.166149
C -1.075933 -1.141867 -1.328751
C -0.091766 2.507059 1.423091
C -0.387131 2.420938 -1.065715
C -4.397348 -0.310271 0.642171
C -2.784355 -2.256744 0.934164
C 1.313600 -0.250641 1.223942
C 1.996188 0.742588 -0.873396
C 2.482399 -1.039759 1.235975
C 3.169774 -0.045059 -0.862031
C 3.439493 -0.951332 0.192163
C 4.715465 -1.775969 0.219878
H -2.343555 1.435531 0.679612
H -1.395113 0.118860 1.389161
H -3.723030 -1.653140 -0.909915
H -1.586221 -1.859839 -2.002409
H -0.459395 -1.716795 -0.618182
H -0.392167 -0.525344 -1.933329
H -0.035660 1.953276 2.378390
H 0.827959 3.112741 1.329471
H -0.957145 3.194609 1.473704
H -0.461124 1.824644 -1.989480
H -1.319408 3.007579 -0.997623
H 0.459931 3.127274 -1.156690
H -4.692940 0.536641 -0.001415
H -5.288094 -0.940134 0.824266
H -4.073283 0.092764 1.619466
H -2.291535 -1.831027 1.828443
H -3.642505 -2.858086 1.287339
H -2.070891 -2.942956 0.445470
H -3.118146 0.079516 -2.354019
H 0.605754 -0.352424 2.055860
H 1.831295 1.425040 -1.713080
H 2.656636 -1.733520 2.068421
H 3.886413 0.046655 -1.688370
H 5.082951 -1.987373 -0.799995
H 5.524454 -1.242110 0.756153
H 4.563564 -2.741292 0.734791


