%chk=000287634.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287634

0 1
O -3.401708 1.370067 1.114403
O -3.857078 1.796743 -1.104442
O -0.834991 -3.209304 -0.161757
O 6.495153 1.006413 -0.160874
C -2.350671 -0.021130 -0.593986
C -3.629185 0.723533 -0.157488
C -2.155970 -1.258352 0.306485
C -4.883653 -0.155413 -0.102270
C -3.387099 -2.174904 0.242797
C -1.115293 0.887854 -0.533656
C -4.638020 -1.426809 0.716407
C -0.879159 -2.001307 -0.068106
C 0.136661 0.138292 -1.000222
C 0.344159 -1.148253 -0.257587
C -3.912723 2.720904 1.078772
C -4.183730 3.016095 -0.402755
C 1.521826 -1.592852 0.205038
C 2.798232 -0.864636 0.128139
C 3.840159 -1.378030 -0.671769
C 2.998749 0.311448 0.861122
C 5.060694 -0.721070 -0.744701
C 4.222523 0.987666 0.808346
C 5.239542 0.463012 0.003474
C 6.808444 2.218432 0.565832
H -2.511440 -0.349980 -1.652248
H -2.024338 -0.903419 1.365725
H -5.187104 -0.407020 -1.138075
H -5.723655 0.421212 0.327558
H -3.214095 -3.076561 0.864136
H -3.526058 -2.555870 -0.787584
H -0.980676 1.267500 0.499273
H -1.285654 1.782505 -1.165234
H -5.521349 -2.089938 0.651325
H -4.532070 -1.158075 1.787543
H 1.024093 0.798161 -0.905104
H 0.062642 -0.091531 -2.086255
H -3.116831 3.337142 1.527393
H -4.816603 2.742910 1.708729
H -5.238937 3.240921 -0.626950
H -3.525912 3.785100 -0.839474
H 1.594340 -2.579637 0.682372
H 3.681101 -2.295783 -1.239730
H 2.195028 0.704400 1.484574
H 5.877576 -1.095032 -1.357936
H 4.363643 1.894522 1.385371
H 7.843778 2.406146 0.251905
H 6.752533 2.041202 1.643605
H 6.149926 3.032325 0.249979


%chk=000287634-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287634

0 1
O -4.158609 0.976811 1.267417
O -4.004278 2.088179 -0.827219
O -0.635000 -2.937112 0.521617
O 7.003265 0.511803 0.019227
C -2.389353 0.260963 -0.280725
C -3.846669 0.755131 -0.168058
C -2.265379 -1.152748 0.343218
C -4.848452 -0.222530 -0.804555
C -3.243524 -2.156235 -0.317919
C -1.361149 1.207629 0.358249
C -4.697412 -1.644046 -0.211958
C -0.821952 -1.687536 0.363414
C 0.070691 0.755332 -0.000425
C 0.333073 -0.730620 0.223120
C -4.988612 2.196873 1.325099
C -4.376690 3.070502 0.214831
C 1.588066 -1.300573 0.316285
C 2.932043 -0.733615 0.201825
C 4.027326 -1.558787 0.621746
C 3.258934 0.555138 -0.318168
C 5.355895 -1.122724 0.557765
C 4.592111 1.004918 -0.399998
C 5.647452 0.169450 0.047072
C 7.365054 1.831032 -0.509488
H -2.178686 0.190701 -1.369830
H -2.558135 -1.053896 1.413754
H -4.661309 -0.238141 -1.895916
H -5.874307 0.162819 -0.655688
H -3.132645 -3.142920 0.162895
H -2.964157 -2.285650 -1.383902
H -1.505333 1.212330 1.454929
H -1.518207 2.239918 -0.005173
H -5.385326 -2.337359 -0.731893
H -4.999658 -1.620168 0.853458
H 0.799970 1.347955 0.585512
H 0.256836 1.000566 -1.068901
H -4.884674 2.612312 2.339490
H -6.050958 1.958662 1.117540
H -5.087370 3.783453 -0.234823
H -3.476731 3.606603 0.575058
H 1.563476 -2.381085 0.528213
H 3.811282 -2.561211 1.010028
H 2.472755 1.210608 -0.697156
H 6.184358 -1.756901 0.886748
H 4.796645 1.996172 -0.815804
H 8.460915 1.878896 -0.433562
H 6.912658 2.642320 0.092777
H 7.058566 1.936382 -1.568028


