%chk=000150569.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150569

0 1
 O    1.014900      0.6991000     -6.1500002E-02
 O    4.246500      -1.799900      0.1754000    
 O   -1.513400      0.9271000      0.3368000    
 N   -6.077000      0.7715000     -1.4100000E-02
 N   -2.738500     -0.6833000     -0.7957000    
 C   0.8498000     -0.6634000     -1.5900001E-02
 C    1.905200      -1.571500      6.5399997E-02
 C  -0.4646000      -1.133300     -5.4299999E-02
 C   -4.896600     -6.0800001E-02  0.1798000    
 C   -3.930000      0.1131000     -0.9824000    
 C    3.436600      0.4083000      5.7900000E-02
 C    3.281300      -1.053500      0.1053000    
 C    2.292400       1.201300     -2.2700001E-02
 C   -1.594500     -0.2173000     -0.1400000    
 C    1.657700      -2.946100      0.1086000    
 C  -0.7168000      -2.505000     -1.0500000E-02
 C   0.3424000      -3.409300      7.0299998E-02
 C    4.705000      0.9937000      9.4099998E-02
 C    2.417000       2.591400     -6.7500003E-02
 C   -5.700100       2.181200     -0.1362000    
 C   -7.021700      0.5933000       1.090300    
 C    4.823000       2.382800      4.8799999E-02
 C    3.681400       3.180500     -3.1700000E-02
 H   -5.189300      -1.117300      0.2375000    
 H   -4.392500      0.1775000       1.126400    
 H   -3.591100       1.145100      -1.105400    
 H   -4.389900     -0.2094000      -1.923200    
 H   -2.742300      -1.603800      -1.222000    
 H    2.469500      -3.664900      0.1737000    
 H   -1.724000      -2.912100     -3.3000000E-03
 H   0.1427000      -4.476300      0.1117000    
 H    5.605000      0.3887000      0.1571000    
 H    1.534000       3.222000     -0.1300000    
 H   -5.240200       2.399300      -1.104800    
 H   -5.031900       2.509300      0.6684000    
 H   -6.592800       2.818200     -0.1037000    
 H   -7.326600     -0.4562000       1.170100    
 H   -7.935800       1.170900      0.9131000    
 H   -6.597000      0.9037000       2.051800    
 H    5.805800       2.844700      7.6499999E-02
 H    3.776900       4.261900     -6.6699997E-02


%chk=000150569-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150569

0 1
O 1.158458 0.729185 -0.119943
O 4.366636 -1.960879 0.232023
O -1.601411 1.009494 0.968728
N -6.151788 0.871952 -0.125434
N -2.570575 -0.290814 -0.705791
C 0.919396 -0.625838 0.132729
C 1.978236 -1.567813 0.246513
C -0.442961 -1.018779 0.235513
C -4.951256 0.018918 0.017410
C -3.769567 0.553681 -0.830414
C 3.598319 0.311477 -0.098280
C 3.398851 -1.139086 0.134084
C 2.483817 1.185605 -0.214130
C -1.564976 -0.002426 0.207048
C 1.657108 -2.933756 0.466342
C -0.722029 -2.386579 0.447098
C 0.319357 -3.344480 0.563352
C 4.902407 0.865896 -0.211822
C 2.642269 2.570762 -0.434111
C -6.042899 2.153769 0.605389
C -7.401004 0.158695 0.212039
C 5.078485 2.240861 -0.432308
C 3.943745 3.092917 -0.542454
H -5.209742 -0.998179 -0.335469
H -4.614099 -0.074587 1.080391
H -3.484736 1.564788 -0.493858
H -4.077873 0.610530 -1.889043
H -2.451166 -1.087000 -1.334231
H 2.490858 -3.637870 0.555081
H -1.765655 -2.703425 0.554995
H 0.073943 -4.396580 0.737865
H 5.751075 0.180091 -0.120123
H 1.752698 3.202498 -0.506826
H -5.152303 2.715030 0.277224
H -5.972379 2.017687 1.713962
H -6.930049 2.775386 0.389507
H -7.496205 -0.747200 -0.412838
H -8.266908 0.811164 -0.000975
H -7.462378 -0.151214 1.286207
H 6.085700 2.660867 -0.517799
H 4.081099 4.166456 -0.710249


