%chk=000129987.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129987

0 1
 O   -2.294400     -0.6729000       1.888300    
 O  -0.2348000       1.873700      -1.541400    
 O   -4.750300       1.177600      -1.610400    
 O    1.877000      -2.068100     -8.2999999E-03
 O   0.3614000       2.277400      0.8675000    
 O    4.878300       1.362000       1.099200    
 O   -4.137300      -2.120600     -0.6505000    
 O   -6.033600      -2.345300      0.5749000    
 O    4.552200     -0.5239000      -1.835000    
 O    6.134400      -2.042400      -1.253400    
 N   -3.570700      0.2907000      0.1989000    
 N  -0.1271000     -0.3173000      0.1987000    
 N   -2.498300       1.512200      -1.518300    
 N    3.445100     -0.3933000      0.5337000    
 N    2.638000       1.803100      0.9787000    
 C   -1.148700      0.7227000      0.3426000    
 C   -2.375200      4.3299999E-02  0.8863000    
 C   -1.230800       1.415300     -0.9816000    
 C    1.070500      8.1799999E-02  0.4144000    
 C   -3.687900       1.004800      -1.006600    
 C   -4.781000     -0.2984000      0.7632000    
 C    2.172900     -0.9188000      0.2873000    
 C    1.305000       1.509300      0.7770000    
 C    4.584000      -1.297800      0.4307000    
 C    3.736100      0.9455000      0.8833000    
 C   -5.062000      -1.681400      0.2347000    
 C    5.177200      -1.339200     -0.9540000    
 H   -1.156700       1.384600       1.212600    
 H   -5.640000      0.3341000      0.5157000    
 H   -4.690600     -0.3634000       1.852500    
 H   -2.570800       2.004700      -2.404500    
 H    4.261300      -2.313600      0.6828000    
 H    5.370400     -0.9916000       1.128000    
 H    2.848900       2.765300       1.229600    
 H   -4.342000      -3.022000     -0.9786000    
 H    4.956800     -0.5683000      -2.727500    


%chk=000129987-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129987

0 1
O -2.441591 -0.940976 1.737982
O -0.255931 1.749175 -1.611802
O -4.877669 1.344791 -1.524253
O 2.071910 -1.971368 0.241863
O 0.663666 2.591899 1.260868
O 5.144908 1.463498 0.985229
O -4.190560 -2.123661 -0.909308
O -5.938647 -2.630716 0.544664
O 4.285491 -0.690798 -1.898739
O 5.676034 -2.498653 -1.425822
N -3.680722 0.260720 0.179992
N -0.052627 -0.197969 0.450128
N -2.566035 1.569286 -1.483538
N 3.597582 -0.271207 0.649478
N 2.879030 1.965446 1.066449
C -1.217389 0.692318 0.401612
C -2.464832 -0.094488 0.816142
C -1.275220 1.366078 -0.994111
C 1.152232 0.266612 0.624282
C -3.784833 1.075924 -0.970121
C -4.908497 -0.406595 0.647463
C 2.269409 -0.761714 0.494030
C 1.512072 1.695491 0.989932
C 4.691481 -1.234494 0.431315
C 3.956171 1.070916 0.894731
C -5.082303 -1.832209 0.121204
C 4.943614 -1.568943 -1.039529
H -1.116918 1.559085 1.099345
H -5.774547 0.189906 0.314992
H -4.902899 -0.459451 1.747348
H -2.654185 2.101175 -2.356272
H 4.464383 -2.178554 0.950686
H 5.616834 -0.802559 0.848116
H 3.150310 2.929800 1.289318
H -4.325094 -3.059530 -1.219111
H 4.472673 -0.938434 -2.844063


