%chk=000221692.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221692

0 1
O -0.941802 0.006941 0.578043
O 0.106841 -1.409219 -0.837854
C -4.566708 -0.127625 0.413050
C -3.214515 0.585472 0.621967
C -2.114166 0.116726 -0.330372
C -5.118287 0.110121 -0.997357
C -4.465838 -1.626913 0.715937
C -1.749267 1.105290 -1.422831
C 0.112323 -0.773135 0.191483
C 1.177269 -0.716301 1.257516
C 2.474609 -0.167293 0.729232
C 3.050901 -0.708313 -0.430732
C 3.123548 0.870536 1.413081
C 4.270220 -0.214813 -0.898090
C 4.345733 1.358231 0.940046
C 4.921467 0.817190 -0.213059
H -5.286818 0.323609 1.144833
H -2.870074 0.422166 1.667237
H -3.356441 1.679942 0.538882
H -2.299200 -0.902280 -0.738544
H -4.494041 -0.358697 -1.766000
H -5.180063 1.178464 -1.229192
H -6.125526 -0.308094 -1.103087
H -4.093437 -1.807101 1.730038
H -5.442258 -2.115822 0.630723
H -3.786178 -2.139456 0.024665
H -1.342377 2.036281 -1.008457
H -0.981760 0.687787 -2.091037
H -2.619861 1.363399 -2.036380
H 1.342054 -1.747318 1.649073
H 0.810953 -0.121647 2.125514
H 2.533731 -1.504829 -0.972353
H 2.680852 1.300702 2.308949
H 4.714131 -0.634996 -1.799537
H 4.848559 2.163636 1.472895
H 5.872527 1.198461 -0.578685


%chk=000221692-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221692

0 1
O -0.858195 -0.025536 0.752590
O 0.038800 -1.697666 -0.611014
C -4.605413 -0.075914 0.342285
C -3.229904 0.560751 0.705272
C -2.046646 0.114405 -0.180510
C -5.039163 0.207428 -1.116598
C -4.640399 -1.594346 0.645875
C -1.647265 1.105864 -1.281840
C 0.118816 -0.949825 0.393397
C 1.290334 -0.913519 1.371461
C 2.521219 -0.248813 0.750418
C 3.142006 -0.810107 -0.395571
C 3.059039 0.934766 1.313302
C 4.282522 -0.199686 -0.961787
C 4.202651 1.545484 0.747629
C 4.818623 0.979131 -0.391399
H -5.348174 0.410677 1.009153
H -2.987618 0.294254 1.751723
H -3.316069 1.664799 0.669132
H -2.217276 -0.888324 -0.614110
H -4.377282 -0.304347 -1.840761
H -5.021461 1.290357 -1.342312
H -6.066900 -0.159795 -1.294454
H -4.388801 -1.796308 1.703710
H -5.646112 -2.009337 0.448062
H -3.923079 -2.154248 0.016435
H -1.351366 2.072826 -0.837210
H -0.804759 0.714998 -1.877711
H -2.498657 1.284670 -1.961443
H 1.524732 -1.961993 1.633463
H 0.983762 -0.381678 2.285669
H 2.718876 -1.714946 -0.846679
H 2.582592 1.379560 2.195429
H 4.753215 -0.642767 -1.846802
H 4.609424 2.459479 1.195187
H 5.705029 1.450808 -0.830394


