%chk=000130451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130451

0 1
 O  -0.2604000       2.266100       1.859200    
 O   0.2604000       2.266100      -1.859100    
 O   -5.876700     -0.7232000      0.4731000    
 O    5.876800     -0.7232000     -0.4731000    
 N   -3.838700      -1.170400     -0.6245000    
 N    3.838700      -1.170500      0.6245000    
 C  -0.6919000      0.5666000      0.2152000    
 C   0.6920000      0.5665000     -0.2152000    
 C   -1.596900     -0.2947000     -0.4054000    
 C    1.596900     -0.2947000      0.4054000    
 C   -1.123200       1.414100       1.235500    
 C    1.123200       1.414200      -1.235500    
 C   -2.933100     -0.3084000     -5.4000001E-03
 C    2.933100     -0.3084000      5.2999998E-03
 C   -2.459400       1.400500       1.635400    
 C    2.459400       1.400400      -1.635400    
 C   -3.364400      0.5391000       1.015000    
 C    3.364400      0.5391000      -1.015000    
 C   -5.206100      -1.324400     -0.3597000    
 C    5.206100      -1.324500      0.3597000    
 C   -5.834800      -2.365200      -1.252000    
 C    5.834700      -2.365100       1.252000    
 H   -1.263900     -0.9575000      -1.202200    
 H    1.264100     -0.9575000       1.202300    
 H   -2.808800       2.055700       2.429200    
 H    2.808900       2.055600      -2.429200    
 H   -4.381200      0.5853000       1.379200    
 H    4.381200      0.5854000      -1.379100    
 H   -3.447600      -1.757000      -1.358700    
 H    3.447500      -1.757000       1.358800    
 H  -0.7434000       2.770200       2.536200    
 H   0.7434000       2.770200      -2.536300    
 H   -5.747900      -2.056400      -2.297400    
 H   -6.893100      -2.478100      -1.001200    
 H   -5.332800      -3.326700      -1.111500    
 H    5.748400      -2.056100       2.297400    
 H    6.892900      -2.478500       1.000900    
 H    5.332500      -3.326500       1.112000    


%chk=000130451-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130451

0 1
O -0.463614 2.855086 1.433190
O 0.464066 2.855100 -1.432765
O -5.846742 -0.922186 0.353515
O 5.845593 -0.924109 -0.356193
N -3.698952 -1.378653 -0.479812
N 3.698491 -1.379828 0.479075
C -0.727728 0.818043 0.165172
C 0.727759 0.817866 -0.164955
C -1.559040 -0.237295 -0.269874
C 1.558814 -0.237774 0.269853
C -1.317028 1.852571 0.944185
C 1.317250 1.852275 -0.943991
C -2.946640 -0.275124 0.026446
C 2.946339 -0.276029 -0.026781
C -2.698123 1.822603 1.242311
C 2.698269 1.821866 -1.242427
C -3.521807 0.772724 0.789530
C 3.521683 0.771659 -0.789930
C -5.055788 -1.654378 -0.314701
C 5.055161 -1.655833 0.313115
C -5.537070 -2.927025 -1.010960
C 5.537376 -2.926841 1.011707
H -1.108722 -1.029847 -0.882254
H 1.108352 -1.030251 0.882226
H -3.142457 2.625325 1.845635
H 3.142745 2.624463 -1.845813
H -4.588160 0.748882 1.018541
H 4.587951 0.747386 -1.019329
H -3.167663 -2.045248 -1.043648
H 3.167378 -2.046171 1.043377
H -0.983189 3.550546 1.907254
H 0.983771 3.550418 -1.906897
H -6.325912 -2.661645 -1.735982
H -5.995246 -3.593938 -0.260472
H -4.741208 -3.480375 -1.539948
H 6.311845 -2.657400 1.750792
H 6.014043 -3.585629 0.265761
H 4.738502 -3.490135 1.525447


