%chk=000189521.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189521

0 1
O 0.488619 1.041077 -0.634591
O -2.006622 2.442032 -0.912227
O -4.296631 -1.808912 -0.504063
O -4.287556 1.091614 -0.730012
O -1.899095 -3.040602 -0.194947
O 0.580675 -2.973534 -0.239597
C 1.966965 -1.107795 -0.605903
C -0.634808 -0.990899 -0.451745
C 2.491881 -0.522471 0.713727
C 0.614354 -1.745181 -0.413687
C -0.725034 0.426715 -0.585676
C -1.859658 -1.720132 -0.373205
C 3.849910 0.095071 0.513590
C -1.964888 1.076304 -0.665260
C -3.122081 -1.071394 -0.454792
C -3.177337 0.322118 -0.615567
C 3.967413 1.363813 -0.075725
C 5.006617 -0.591554 0.911731
C 5.226421 1.939513 -0.258859
C 6.264649 -0.011065 0.726983
C 6.377932 1.254379 0.143126
C 0.574166 2.480392 -0.830866
C -2.617690 3.215578 0.159612
C -4.576102 -2.558720 0.712602
C -5.592853 0.442989 -0.755317
H 2.679327 -1.874265 -0.984796
H 1.924856 -0.317346 -1.388494
H 1.777136 0.241608 1.092948
H 2.527459 -1.315664 1.488876
H 3.069011 1.898779 -0.395286
H 4.926936 -1.579012 1.362805
H 5.312863 2.923503 -0.716086
H 7.159273 -0.548112 1.038531
H -0.919053 -3.481350 -0.151082
H 7.357972 1.704033 0.000810
H 1.667684 2.611358 -0.896627
H 0.150990 2.999981 0.032160
H 0.059505 2.769084 -1.754794
H -2.474752 4.242000 -0.192595
H -3.683877 2.968076 0.225303
H -2.108690 3.033561 1.107085
H -4.619734 -1.891846 1.574264
H -3.814317 -3.337056 0.845469
H -5.551221 -3.000439 0.484723
H -6.248471 1.287133 -0.996109
H -5.617332 -0.331233 -1.532895
H -5.808212 0.013773 0.226259


%chk=000189521-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189521

0 1
O 0.372024 1.318936 -0.666887
O -2.137129 2.564507 -0.650712
O -4.362141 -1.764353 -0.129173
O -4.437392 1.104567 -0.352639
O -1.858810 -3.034314 -0.254009
O 0.563030 -2.943076 -0.484246
C 1.970756 -1.017249 -0.659350
C -0.672585 -0.893090 -0.490594
C 2.480277 -0.539268 0.743214
C 0.593148 -1.638730 -0.558193
C -0.795747 0.540700 -0.577784
C -1.893989 -1.665617 -0.336051
C 3.867168 0.075465 0.642935
C -2.059896 1.162778 -0.519496
C -3.167881 -1.033480 -0.263730
C -3.253243 0.375460 -0.395927
C 4.022965 1.473706 0.456872
C 5.030533 -0.735104 0.695924
C 5.307700 2.048432 0.328864
C 6.317197 -0.164946 0.567442
C 6.460236 1.230051 0.382205
C 0.491378 2.226860 -1.836662
C -2.609719 3.284252 0.554720
C -4.448491 -2.693352 1.023335
C -5.664648 0.568401 -0.987971
H 2.648181 -1.799745 -1.043937
H 1.976413 -0.154972 -1.341484
H 1.765411 0.202493 1.139274
H 2.488195 -1.410846 1.424325
H 3.128424 2.108628 0.423541
H 4.925648 -1.817279 0.845243
H 5.411693 3.131387 0.193968
H 7.205801 -0.804878 0.615773
H -0.826416 -3.296862 -0.340320
H 7.457466 1.674164 0.285693
H 1.484455 2.690811 -1.733361
H -0.307976 2.983473 -1.815337
H 0.443145 1.641653 -2.774722
H -2.570624 4.351656 0.288307
H -3.644340 2.987698 0.795944
H -1.937645 3.082405 1.410362
H -4.294250 -2.144123 1.972141
H -3.704350 -3.498180 0.920712
H -5.471876 -3.096914 0.982275
H -6.310866 1.451124 -1.113307
H -5.425732 0.122457 -1.968876
H -6.138896 -0.189790 -0.348499


