%chk=000114721.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000114721

0 1
O 3.344805 1.325009 -0.178951
O 4.824586 -0.348868 0.477476
O -0.185603 -1.795439 -0.745163
O -1.048153 2.778276 0.618149
O -5.062351 -1.109359 1.607804
C 2.852438 -1.010177 -0.766352
C 3.982677 0.079103 -0.617667
C 1.619938 -0.221183 -0.453334
C 1.988333 1.104061 -0.082643
C 0.274272 -0.551480 -0.411249
C -0.723002 0.389817 -0.022480
C 3.227219 -1.991877 0.321240
C -2.095465 -0.099173 0.077478
C 1.078520 2.073578 0.277430
C -0.292293 1.696345 0.292542
C -2.847505 -0.509999 -1.176755
C 4.300083 -1.541249 0.991031
C -4.224441 -0.974716 -0.672842
C -2.823854 -0.296966 1.194910
C -4.163609 -0.834346 0.852975
C -2.495954 2.735658 0.601144
H 2.832261 -1.473194 -1.772121
H 4.641984 0.358085 -1.447047
H 2.654150 -2.878405 0.506836
H 1.371907 3.086392 0.543291
H -2.919178 0.317616 -1.901581
H -2.300515 -1.325407 -1.693210
H 4.878265 -1.891803 1.826301
H -4.442911 -2.020500 -0.950928
H -5.053338 -0.375627 -1.084533
H -2.533809 -0.139720 2.219522
H 0.557764 -2.429036 -0.930881
H -2.869927 2.310249 -0.332872
H -2.742505 3.804516 0.674792
H -2.856690 2.190417 1.480288


%chk=000114721-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000114721

0 1
O 3.350156 1.359889 0.163137
O 4.944330 -0.442043 0.447134
O -0.061729 -1.761320 -1.070215
O -1.256323 2.485838 1.149981
O -5.314702 -0.595304 1.702021
C 2.908876 -0.844542 -0.866802
C 4.021879 0.212787 -0.495474
C 1.634499 -0.122625 -0.445114
C 1.965835 1.094749 0.180680
C 0.289358 -0.513575 -0.516558
C -0.755349 0.304071 0.029747
C 3.292099 -2.033586 0.021828
C -2.150868 -0.176783 0.103079
C 1.004044 1.963663 0.701268
C -0.350591 1.560868 0.606305
C -2.855501 -0.940628 -1.024592
C 4.401785 -1.720507 0.732861
C -4.289402 -1.197179 -0.498336
C -2.994135 0.001599 1.177577
C -4.321378 -0.587855 0.919246
C -2.409005 2.940430 0.343161
H 2.930932 -1.095045 -1.944372
H 4.634635 0.626215 -1.308434
H 2.731504 -2.964302 0.104831
H 1.254445 2.927316 1.146587
H -2.844533 -0.340315 -1.955100
H -2.311444 -1.870737 -1.254574
H 4.962930 -2.281766 1.478400
H -4.541916 -2.271124 -0.439643
H -5.068546 -0.719524 -1.119417
H -2.739409 0.497970 2.116286
H 0.749951 -2.265422 -1.326905
H -2.323251 2.604542 -0.705793
H -2.395991 4.042057 0.391550
H -3.345087 2.552783 0.778252


