%chk=000135607.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135607

0 1
 O   -1.064100      -3.980600     -0.3800000    
 O   2.5900001E-02  -2.907000      -2.211000    
 O   0.8684000      -4.556700       1.866000    
 O   -1.489700      -2.026200      0.8602000    
 O    2.737500     -0.8679000       1.050600    
 O    1.325000       1.641900      -2.891600    
 O    4.067000      8.6999997E-02   2.660600    
 O    4.775900       2.938300       2.074200    
 O   -3.541000      -2.807800      0.1670000    
 O   -5.532700       3.845800      0.6756000    
 O   -3.468900       4.429400      0.2070000    
 N   -4.334600       3.552500      0.4441000    
 C    1.195200      -3.205400     -8.2900003E-02
 C   0.1799000      -3.791000      -1.076400    
 C   0.4964000      -3.321400       1.257600    
 C    1.338100      -1.839300     -0.6414000    
 C  -0.9823000      -3.354100      0.9062000    
 C   0.6670000      -1.753000      -1.848100    
 C    2.037900     -0.7429000     -0.1698000    
 C    2.054300      0.4533000     -0.8991000    
 C    2.805400       1.570000     -0.3452000    
 C   0.6610000     -0.5943000      -2.603900    
 C    1.358200      0.5177000      -2.119600    
 C    2.932000       2.918000     -0.9754000    
 C    3.447500       1.419800      0.8141000    
 C    3.807700       3.707100     -3.5999999E-03
 C    3.462800      0.1880000       1.600600    
 C    4.094800       2.711500       1.085800    
 C   -2.788200      -1.896100      0.4729000    
 C   -3.193700     -0.4677000      0.4648000    
 C   0.2684000       2.565600      -2.643000    
 C   -4.511200     -0.1472000      0.7197000    
 C   -2.240000      0.4948000      0.2033000    
 C   -4.892100       1.194600      0.7126000    
 C   -2.620800       1.836700      0.1964000    
 C   -3.946900       2.186700      0.4512000    
 H    2.152100      -3.736300     -0.1330000    
 H   0.4998000      -4.770800      -1.447900    
 H   0.7519000      -2.514900       1.951800    
 H   -1.563100      -3.943200       1.625400    
 H   0.1259000     -0.5515000      -3.547300    
 H   0.3821000      -4.625500       2.705400    
 H    3.403300       2.876600      -1.962400    
 H    1.977400       3.439300      -1.044300    
 H    3.277800       4.570900      0.4083000    
 H    4.742100       4.024400     -0.4754000    
 H  -0.6142000       2.262700      -3.215400    
 H   0.5795000       3.554900      -2.989600    
 H   3.1999999E-03   2.618500      -1.582800    
 H   -5.255000     -0.9105000      0.9281000    
 H   -1.204300      0.2490000     -5.1000002E-03
 H   -5.933700       1.430100      0.9160000    
 H   -1.858700       2.583600     -8.1000002E-03


%chk=000135607-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135607

0 1
O -1.055971 -4.094829 -0.541174
O -0.106437 -2.711897 -2.307568
O 1.020722 -4.751583 1.577333
O -1.440713 -2.099231 0.748467
O 2.745234 -0.947643 0.993317
O 1.126318 2.047948 -2.500621
O 4.125766 -0.253402 2.717471
O 4.938884 2.768789 2.472972
O -3.555631 -2.748261 1.519721
O -5.581592 3.945722 0.483238
O -3.500861 4.429619 -0.316957
N -4.371585 3.617490 0.182309
C 1.203694 -3.222069 -0.277119
C 0.154392 -3.793682 -1.291254
C 0.551303 -3.447633 1.112899
C 1.316834 -1.777860 -0.711119
C -0.958146 -3.506042 0.782068
C 0.541646 -1.558759 -1.862999
C 2.017005 -0.697906 -0.161493
C 1.964758 0.609446 -0.768357
C 2.734936 1.647627 -0.134200
C 0.435519 -0.314078 -2.512831
C 1.154669 0.764949 -1.955887
C 2.878303 3.099549 -0.570205
C 3.481243 1.400091 1.024862
C 3.827277 3.744083 0.467767
C 3.543758 0.112364 1.691920
C 4.188328 2.631496 1.475206
C -2.789396 -1.864277 1.079300
C -3.161254 -0.435205 0.848748
C 0.320054 2.270788 -3.711740
C -4.491380 -0.037809 1.144421
C -2.228206 0.506926 0.342766
C -4.896297 1.292442 0.931677
C -2.620578 1.840267 0.125741
C -3.950961 2.209567 0.421629
H 2.164439 -3.760900 -0.297384
H 0.410371 -4.689613 -1.869784
H 0.787046 -2.637383 1.824398
H -1.594723 -4.101132 1.454036
H -0.185878 -0.214062 -3.403548
H 0.895595 -4.834721 2.555092
H 3.267873 3.149441 -1.602276
H 1.887954 3.586313 -0.609651
H 3.361545 4.585042 1.011503
H 4.756363 4.133426 0.014827
H 0.688323 1.650423 -4.549488
H 0.451068 3.336430 -3.946358
H -0.747912 2.056258 -3.520672
H -5.189964 -0.784388 1.534524
H -1.208310 0.185211 0.121156
H -5.913191 1.629530 1.147203
H -1.926031 2.590526 -0.260687


