%chk=000238633.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238633

0 1
O 4.029862 0.949125 0.097252
O -1.911583 3.042479 -0.062715
C -0.078550 1.558521 0.040580
C 2.648992 1.052861 0.083490
C 0.410615 0.305432 -0.352964
C 0.822018 2.568488 0.437274
C 1.780360 0.037547 -0.336546
C 2.189597 2.325229 0.472367
C -1.532368 1.888479 0.022669
C -4.782726 -0.161042 -0.163525
C 4.638393 -0.315466 0.081172
C -2.492583 0.758674 0.134139
C -3.767281 0.899653 -0.256206
C -4.466172 -1.500688 -0.441975
C -6.097560 0.179712 0.201212
C 4.265410 -1.334134 0.963843
C 5.721889 -0.428482 -0.798985
C -5.452603 -2.486709 -0.352600
C -7.076134 -0.811471 0.297143
C 5.016047 -2.513134 0.955314
C 6.457150 -1.615545 -0.781719
C -6.756288 -2.145184 0.019317
C 6.104709 -2.655498 0.087524
H -0.278325 -0.471806 -0.689922
H 0.427101 3.551221 0.717556
H 2.160084 -0.928773 -0.659599
H 2.902011 3.087910 0.781278
H -2.114103 -0.161122 0.576871
H -4.119524 1.857115 -0.668515
H -3.453515 -1.770674 -0.736667
H -6.351454 1.217144 0.417170
H 3.426859 -1.204081 1.644058
H 5.975476 0.395296 -1.463053
H -5.203656 -3.523724 -0.572999
H -8.091685 -0.544820 0.586989
H 4.751735 -3.324061 1.634168
H 7.308784 -1.731781 -1.452343
H -7.522525 -2.915223 0.091398
H 6.682744 -3.577769 0.090049


%chk=000238633-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238633

0 1
O 4.134570 0.982550 -0.114037
O -1.962897 2.855487 0.486005
C -0.079237 1.393517 0.158107
C 2.731958 1.038682 0.004123
C 0.479681 0.125603 -0.160616
C 0.810525 2.481721 0.389698
C 1.874270 -0.060835 -0.240710
C 2.200320 2.314235 0.316402
C -1.552620 1.667093 0.252321
C -4.960121 -0.181823 -0.013092
C 4.840271 -0.250560 -0.035843
C -2.519017 0.550433 0.074591
C -3.867650 0.787418 0.131741
C -4.750086 -1.576272 -0.230702
C -6.302465 0.291582 0.068787
C 4.614596 -1.180494 1.004959
C 5.865421 -0.444823 -0.985024
C -5.840658 -2.456642 -0.361221
C -7.395355 -0.589595 -0.062177
C 5.428775 -2.332692 1.077679
C 6.674379 -1.599546 -0.896834
C -7.168912 -1.968664 -0.278021
C 6.457220 -2.548313 0.129769
H -0.164128 -0.734990 -0.366068
H 0.370058 3.455183 0.627554
H 2.286914 -1.038720 -0.504985
H 2.890167 3.144829 0.491589
H -2.134504 -0.459868 -0.096668
H -4.157417 1.834420 0.308021
H -3.730203 -1.971158 -0.295868
H -6.478905 1.361096 0.236175
H 3.832368 -0.998628 1.748836
H 6.016973 0.305297 -1.766823
H -5.662311 -3.524871 -0.527431
H -8.418839 -0.204830 0.003500
H 5.264167 -3.056029 1.883823
H 7.472682 -1.756477 -1.630240
H -8.014895 -2.657252 -0.380155
H 7.086106 -3.442364 0.195337


