%chk=000152286.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152286

0 1
 O   -3.438900       2.140500     -0.6949000    
 O   -4.996700      0.2581000      -1.818600    
 O   -4.854500      -1.139400       1.545800    
 N    1.198300      -1.254800     -7.3399998E-02
 C   -4.418900       1.524600      0.1483000    
 C   -2.944800       1.467000      0.4725000    
 C   -5.086500      0.2967000     -0.3947000    
 C   -2.211400      0.1637000      0.2552000    
 C   -4.474300     -0.9923000      0.1794000    
 C   -2.960700      -1.025800      0.1178000    
 C  -0.7897000      8.8799998E-02  0.1801000    
 C   -2.304100      -2.245500     -5.0900001E-02
 C  -0.1415000      -1.144100     -1.2000001E-03
 C  -0.9136000      -2.291800     -0.1088000    
 C   4.5000002E-02   1.213400      0.2772000    
 C    1.439300       1.102800      0.2011000    
 C    1.999500     -0.1714000      2.2399999E-02
 C    3.405700     -0.2854000     -5.4000001E-02
 C    2.255700       2.236700      0.3006000    
 C    4.227900      0.8663000      4.7600001E-02
 C    3.638300       2.119400      0.2247000    
 C    4.043200      -1.531900     -0.2322000    
 C    5.625100      0.7441000     -3.0099999E-02
 C    5.433600      -1.638500     -0.3074000    
 C    6.223900     -0.5012000     -0.2064000    
 H   -5.062900       2.160000      0.7395000    
 H   -2.624600       2.086600       1.304700    
 H   -6.151100      0.3441000     -0.1365000    
 H   -4.878300      -1.851700     -0.3691000    
 H   -2.869500      -3.169400     -0.1423000    
 H   -5.492100     -0.5212000      -2.123400    
 H  -0.4315000      -3.258300     -0.2458000    
 H  -0.3923000       2.201900      0.4123000    
 H   -4.409700     -0.4506000       2.068400    
 H    1.820400       3.224200      0.4389000    
 H    4.247000       3.017200      0.3054000    
 H    3.460500      -2.447600     -0.3161000    
 H    6.262700       1.622700      4.6700001E-02
 H    5.895700      -2.611800     -0.4449000    
 H    7.305300     -0.5816000     -0.2647000    


%chk=000152286-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152286

0 1
O -3.446203 2.132609 -0.871835
O -5.388678 0.345908 -1.751839
O -4.896561 -1.303149 1.566483
N 1.248194 -1.277018 -0.086503
C -4.419800 1.549649 0.114768
C -2.950303 1.454756 0.406735
C -5.193037 0.294000 -0.297687
C -2.236426 0.162037 0.202118
C -4.488421 -1.013267 0.160609
C -2.975439 -1.021240 0.042742
C -0.793865 0.126164 0.144665
C -2.299057 -2.271919 -0.149716
C -0.120048 -1.152531 -0.035783
C -0.910386 -2.342067 -0.181851
C 0.028782 1.281253 0.233203
C 1.433373 1.169401 0.176818
C 2.014524 -0.157806 0.023843
C 3.473662 -0.297555 -0.024924
C 2.304180 2.323670 0.262996
C 4.296732 0.878099 0.071400
C 3.675418 2.182569 0.213065
C 4.090079 -1.572564 -0.166909
C 5.715908 0.738735 0.023119
C 5.488355 -1.687659 -0.211800
C 6.306819 -0.526188 -0.116100
H -5.003944 2.322015 0.629728
H -2.520368 2.165316 1.124135
H -6.168195 0.299649 0.232677
H -4.915936 -1.857610 -0.410265
H -2.900018 -3.181883 -0.258453
H -6.054177 -0.346114 -2.000434
H -0.379396 -3.287629 -0.323910
H -0.420992 2.276002 0.323639
H -4.221832 -0.910649 2.177860
H 1.847903 3.315114 0.368720
H 4.325714 3.062800 0.279639
H 3.440272 -2.449261 -0.239942
H 6.341365 1.636410 0.095782
H 5.953747 -2.673181 -0.321529
H 7.397554 -0.622364 -0.152063


