%chk=000020442.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020442

0 1
 O    4.224700       2.570400     -0.5288000    
 O    2.897500      -3.488500     -0.3775000    
 O   -2.801600       3.408900      0.9422000    
 O   -4.263200      -2.576000      0.5534000    
 O    3.585800       1.464200       1.350200    
 O    2.379500      -2.258100       1.460900    
 O   -2.493600       2.384300      -1.062200    
 O   -3.717200      -1.329400      -1.265900    
 N    1.856600     -7.7600002E-02 -0.1282000    
 N   -1.871100      4.4000000E-02  0.2363000    
 C   0.4689000     -0.3713000     -0.4965000    
 C  -0.4627000      0.2994000      0.5242000    
 C   0.2328000      0.1079000      -1.928700    
 C    2.253200       1.230700     -0.6447000    
 C    2.747700      -1.120400     -0.6320000    
 C   -2.719800       1.024100      0.9149000    
 C   -2.239700      -1.313800      0.6386000    
 C    3.410600       1.738700      0.1698000    
 C    2.638400      -2.321700      0.2657000    
 C   -2.670400       2.316500      0.1476000    
 C   -3.456600      -1.732300     -0.1394000    
 H   0.3016000      -1.453000     -0.4677000    
 H  -0.2113000     -3.4600001E-02   1.541400    
 H  -0.2750000       1.379600      0.5159000    
 H   0.9836000     -0.2461000      -2.642400    
 H  -0.7204000     -0.3018000      -2.287600    
 H   0.1351000       1.194600      -2.024900    
 H    2.558700       1.194700      -1.698200    
 H    1.487700       2.005000     -0.5221000    
 H    2.537800      -1.407000      -1.667900    
 H    3.800100     -0.8147000     -0.5819000    
 H   -2.404200       1.181800       1.953400    
 H   -3.774200      0.7233000      0.9226000    
 H   -2.437700      -1.371400       1.716000    
 H   -1.476400      -2.061300      0.4037000    
 H    4.963700       2.906600      2.1800000E-02
 H    2.839300      -4.259600      0.2260000    
 H   -2.748100       4.243200      0.4289000    
 H   -5.060800      -2.824100      3.9200000E-02


%chk=000020442-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020442

0 1
O 4.240238 2.563054 0.542240
O 2.996531 -3.627184 -0.440904
O -3.949476 3.230476 0.249251
O -3.209167 -3.149464 1.122782
O 4.226194 0.345863 1.236769
O 1.153742 -2.719657 0.635687
O -2.343525 2.584418 -1.297742
O -4.163978 -1.468779 -0.162210
N 1.863496 -0.109040 -0.409482
N -1.817408 0.192611 0.302658
C 0.424719 -0.054256 -0.805328
C -0.405276 0.658117 0.302043
C 0.158513 0.541767 -2.208327
C 2.600597 1.149791 -0.484725
C 2.598964 -1.299160 -0.832437
C -2.813582 1.186035 0.722161
C -1.979453 -1.099220 0.989354
C 3.742558 1.249592 0.525692
C 2.139817 -2.566738 -0.115367
C -2.961004 2.357958 -0.238138
C -3.223073 -1.865268 0.557154
H 0.086364 -1.104692 -0.816772
H 0.097114 0.464266 1.278058
H -0.406745 1.748299 0.125326
H 0.644137 -0.059122 -3.000587
H -0.928494 0.562035 -2.392952
H 0.518482 1.584194 -2.287929
H 3.047775 1.373208 -1.486372
H 1.916191 1.990743 -0.279009
H 2.541913 -1.511904 -1.929643
H 3.669393 -1.182435 -0.591246
H -2.626951 1.616603 1.738800
H -3.806037 0.702054 0.762040
H -2.028365 -1.005448 2.104953
H -1.100258 -1.740633 0.797937
H 5.002995 2.619079 1.179673
H 2.687832 -4.454038 0.019629
H -4.060042 3.986528 -0.388648
H -4.035432 -3.634451 0.851709


