%chk=000237185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237185

0 1
O -5.338325 1.052637 -0.279364
O 5.770065 0.267285 -0.007698
C 0.069744 0.581221 0.414474
C -0.694112 -0.715591 0.015964
C 1.540912 0.535804 -0.116046
C -2.130116 -0.593137 0.546554
C -2.868207 0.617888 -0.106221
C 2.217718 -0.750359 0.458175
C 0.002482 -1.955134 0.600990
C -0.672557 1.856240 -0.046340
C 1.474930 -2.076823 0.159343
C -2.156155 1.897060 0.360059
C -3.108641 -1.767371 0.361427
C -4.308038 0.411353 0.467867
C 2.321095 1.756885 0.458662
C -4.505998 -1.127086 0.518097
C 3.697928 -0.827233 0.054304
C 1.576960 0.596191 -1.649229
C -2.910113 0.560953 -1.639702
C 3.815934 1.720314 0.126090
C 4.454150 0.398623 0.579068
C 1.585758 -2.574090 -1.284222
H 0.115941 0.610998 1.531421
H -0.708892 -0.806096 -1.095472
H -2.059280 -0.400329 1.649082
H 2.186998 -0.641352 1.576659
H -0.046721 -1.928566 1.706076
H -0.550112 -2.865359 0.301344
H -0.596932 1.951584 -1.148523
H -0.163032 2.746890 0.368296
H 1.951325 -2.860479 0.807147
H -2.247660 2.012977 1.455619
H -2.642940 2.789252 -0.076135
H -2.939429 -2.561392 1.104516
H -2.992325 -2.236994 -0.629051
H -4.432198 0.883447 1.465446
H 2.185723 1.801266 1.555625
H 1.885973 2.694589 0.063875
H -5.193304 -1.455735 -0.277686
H -4.980181 -1.425726 1.466288
H 4.169403 -1.749291 0.442390
H 3.810617 -0.883446 -1.047103
H 2.605005 0.545014 -2.026764
H 1.027020 -0.247186 -2.093796
H 1.131253 1.521362 -2.027769
H -1.901865 0.623346 -2.068218
H -3.354336 -0.371236 -2.002124
H -3.485274 1.401456 -2.045159
H 3.967017 1.838938 -0.966328
H 4.328253 2.578688 0.595805
H 4.574539 0.365720 1.683687
H 2.630128 -2.717224 -1.581406
H 1.072648 -3.532427 -1.413603
H 1.139055 -1.861201 -1.993416
H -5.353866 0.746821 -1.207156
H 6.336135 1.018662 0.235583


%chk=000237185-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237185

0 1
O -5.421209 1.185417 0.050397
O 5.913850 0.261577 0.271356
C 0.077688 0.599074 0.300195
C -0.695435 -0.720233 -0.041551
C 1.576136 0.558061 -0.191355
C -2.140983 -0.599830 0.481992
C -2.919108 0.617383 -0.103675
C 2.243967 -0.738838 0.409470
C 0.020696 -1.947281 0.572506
C -0.694103 1.869377 -0.166212
C 1.502075 -2.082211 0.134720
C -2.172660 1.904979 0.308255
C -3.118602 -1.794596 0.313566
C -4.304349 0.394787 0.582883
C 2.358523 1.770165 0.416638
C -4.533649 -1.153901 0.511620
C 3.760460 -0.821214 0.108588
C 1.655738 0.647163 -1.743826
C -3.100146 0.558310 -1.643215
C 3.880667 1.713417 0.137614
C 4.497106 0.403344 0.665683
C 1.635604 -2.662494 -1.295790
H 0.120325 0.640225 1.415588
H -0.733177 -0.850088 -1.143400
H -2.060811 -0.406169 1.578442
H 2.155928 -0.599448 1.514174
H -0.023072 -1.853913 1.679629
H -0.528616 -2.873373 0.310001
H -0.664038 1.938836 -1.270593
H -0.181447 2.773541 0.213514
H 1.978110 -2.827001 0.810146
H -2.198391 1.996161 1.414890
H -2.679893 2.801620 -0.098534
H -2.923887 -2.599651 1.043329
H -3.018008 -2.240184 -0.694741
H -4.242705 0.732405 1.633981
H 2.188896 1.791184 1.514745
H 1.958853 2.720251 0.015154
H -5.206961 -1.393190 -0.335196
H -5.034644 -1.519454 1.424491
H 4.185056 -1.737332 0.563283
H 3.963389 -0.883604 -0.977049
H 2.624689 0.291336 -2.133002
H 0.868062 0.052612 -2.236881
H 1.534951 1.694450 -2.078335
H -2.134914 0.557464 -2.176309
H -3.648434 -0.346022 -1.968481
H -3.661985 1.446577 -1.988340
H 4.078802 1.781341 -0.949492
H 4.378353 2.585280 0.611550
H 4.418082 0.398010 1.778436
H 2.693565 -2.747905 -1.603152
H 1.199082 -3.678715 -1.327062
H 1.113843 -2.054903 -2.054058
H -5.649086 0.840522 -0.850283
H 6.411918 1.059283 0.585097


