%chk=000179618.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179618

0 1
O -0.335447 -0.365108 -0.949531
O 1.860436 -2.025029 -0.660600
O 4.255310 -0.999971 0.254994
C 0.813266 0.182634 -0.372801
C 1.904010 -0.697811 -0.299168
C -1.566099 -0.167333 -0.314283
C 0.932023 1.522660 0.009612
C 3.148968 -0.204196 0.160405
C 2.169194 1.984128 0.467380
C 3.278178 1.135831 0.547520
C -1.710146 0.119607 1.045517
C -2.659972 -0.358655 -1.173098
C -3.007774 0.217069 1.558627
C -3.940906 -0.259205 -0.630918
C -4.117526 0.029533 0.729217
H 0.074366 2.188204 -0.062468
H 2.274797 3.028334 0.765125
H 4.243408 1.494978 0.901775
H -0.844146 0.255886 1.689030
H -2.496219 -0.576040 -2.225865
H -3.150010 0.438874 2.616625
H -4.810305 -0.404320 -1.272640
H -5.122060 0.107247 1.139537
H 0.936842 -2.260462 -0.966510
H 4.052211 -1.930454 -0.055084


%chk=000179618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179618

0 1
O -0.314846 -0.423486 -0.894671
O 1.910861 -2.029056 -0.676672
O 4.325324 -1.044731 0.195595
C 0.851290 0.180846 -0.340745
C 1.968261 -0.677159 -0.295383
C -1.593879 -0.207206 -0.306132
C 0.961407 1.535133 0.038517
C 3.221144 -0.189258 0.149516
C 2.216678 2.008841 0.486665
C 3.345679 1.158002 0.545025
C -1.768980 0.110712 1.059663
C -2.698273 -0.400523 -1.163769
C -3.082857 0.239608 1.564147
C -4.003938 -0.271985 -0.642127
C -4.202682 0.051017 0.721296
H 0.093488 2.197745 -0.021050
H 2.318815 3.056858 0.785246
H 4.319549 1.519968 0.885541
H -0.903475 0.248412 1.714626
H -2.521562 -0.644385 -2.215704
H -3.227306 0.483039 2.622539
H -4.864705 -0.420373 -1.303192
H -5.216713 0.152932 1.121585
H 0.995840 -2.234482 -1.001006
H 4.053281 -1.944067 -0.127112


