%chk=000155281.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155281

0 1
 O   -4.545900     -0.3034000     -0.1553000    
 O   -5.201700       1.926600     -0.5156000    
 O   -2.883200      0.6714000       1.525000    
 O   -2.377600       2.880900       1.078300    
 N   1.2800000E-02  -1.706100     -0.1422000    
 N    2.695200      0.7266000      -1.253100    
 C   -1.886300      0.2308000      -1.149400    
 C   0.5283000     -0.6016000      -1.000000    
 C  -0.4149000      0.6048000     -0.8440000    
 C   -2.297000      -1.114600     -0.5664000    
 C   -2.865400       1.346000     -0.7229000    
 C    1.935800     -0.2352000     -0.6527000    
 C   -3.781600      -1.420400     -0.6348000    
 C   -1.351100      -1.940600     -8.6800002E-02
 C   0.9981000      -2.676500      0.3750000    
 C    2.696800     -0.8555000      0.3135000    
 C   -4.316100      0.8848000     -0.9161000    
 C    2.141700      -1.969400       1.130000    
 C    3.971900     -0.2281000      0.3227000    
 C   -2.674700       1.750100      0.7174000    
 C    3.944100      0.7607000     -0.6682000    
 C   -4.248900      -2.636500      0.1620000    
 C    5.152300     -0.4015000       1.072800    
 C    5.042700       1.583400     -0.9419000    
 C    6.257100      0.4159000      0.8088000    
 C    6.200900       1.392500     -0.1833000    
 C   -2.733000      0.9149000       2.927200    
 H   -1.971600      0.1237000      -2.241200    
 H   0.5100000     -0.9465000      -2.042700    
 H  -0.3170000      0.9897000      0.1796000    
 H  -0.1086000       1.422500      -1.509100    
 H   -2.687100       2.244700      -1.327700    
 H   -4.052400      -1.589600      -1.685500    
 H   -1.593600      -2.900400      0.3526000    
 H    1.400900      -3.249000     -0.4703000    
 H   0.5232000      -3.394400       1.054500    
 H   -4.525000      0.6820000      -1.973000    
 H    1.759800      -1.558200       2.072400    
 H    2.922800      -2.697000       1.375600    
 H    2.392100       1.328800      -2.006400    
 H   -5.337500      -2.741500      8.9199997E-02
 H   -3.793900      -3.562100     -0.2038000    
 H   -4.019100      -2.523300       1.227700    
 H   -4.891400       2.319300      0.3153000    
 H    5.211800      -1.158700       1.849400    
 H    5.001300       2.343700      -1.714700    
 H    7.169200      0.2859000       1.385200    
 H    7.071200       2.016100     -0.3717000    
 H   -1.710400       1.235600       3.147500    
 H   -2.929300     -2.1199999E-02   3.456700    
 H   -3.455500       1.665900       3.260600    


%chk=000155281-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155281

0 1
O -4.669467 -0.346608 -0.310901
O -5.407185 1.826154 -0.898999
O -2.115344 1.102605 1.657757
O -3.926911 2.484030 1.290129
N 0.010357 -1.663619 -0.013052
N 2.668153 0.753924 -1.168400
C -1.913690 0.284236 -1.110504
C 0.485973 -0.589033 -0.920978
C -0.443825 0.645701 -0.772785
C -2.305284 -1.095731 -0.582600
C -2.943219 1.365568 -0.652535
C 1.923188 -0.285085 -0.585430
C -3.768007 -1.473767 -0.737616
C -1.363137 -1.933892 -0.048142
C 0.970944 -2.731523 0.337473
C 2.716986 -0.967088 0.333426
C -4.374392 0.874017 -1.086930
C 2.192944 -2.158748 1.095241
C 4.017203 -0.325096 0.337045
C -3.039621 1.706330 0.834699
C 3.958696 0.754071 -0.618914
C -4.248894 -2.696517 0.047381
C 5.228446 -0.551313 1.042537
C 5.062112 1.594314 -0.878386
C 6.333853 0.284913 0.787536
C 6.251975 1.346123 -0.161812
C -2.270444 1.365799 3.114549
H -2.017036 0.279303 -2.222035
H 0.408949 -0.949263 -1.979680
H -0.367758 0.999962 0.266537
H -0.099773 1.458563 -1.442779
H -2.744873 2.319920 -1.182642
H -3.985687 -1.630187 -1.823777
H -1.649692 -2.898493 0.384712
H 1.330268 -3.253763 -0.579530
H 0.442099 -3.473675 0.961619
H -4.363507 0.632079 -2.171038
H 1.893256 -1.874683 2.123565
H 2.967288 -2.945762 1.186164
H 2.321476 1.414474 -1.860237
H -5.337944 -2.804585 -0.087831
H -3.759907 -3.619957 -0.311063
H -4.044015 -2.573539 1.125075
H -5.275215 2.263615 -0.005941
H 5.304391 -1.362598 1.775548
H 5.005411 2.411384 -1.606618
H 7.274457 0.121210 1.325270
H 7.128770 1.979386 -0.337636
H -2.182414 2.445771 3.317014
H -1.453777 0.799673 3.582740
H -3.255979 1.007397 3.452975


