%chk=000030334.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030334

0 1
 O  -0.3287000       1.780500       1.729900    
 O    1.640400       1.347400      -1.945300    
 N  -0.6910000      5.6899998E-02  0.1287000    
 C    1.544600      0.4933000      0.8284000    
 C    2.358200       1.687300      0.3279000    
 C    1.475500     -0.6112000     -0.1934000    
 C   6.4499997E-02  0.9041000      0.9713000    
 C    2.066600     -1.4500000E-02   2.173200    
 C   0.1496000     -0.8259000     -0.5854000    
 C    1.736700       2.325300     -0.9134000    
 C    2.521900      -1.337100     -0.7469000    
 C  -0.1391000      -1.735900      -1.593300    
 C   -2.106400      8.6700000E-02  2.3499999E-02
 C    1.221000      -1.134500       2.691900    
 C    2.585500       3.486400      -1.413900    
 C    2.229700      -2.280800      -1.729900    
 C   0.9093000      -2.472000      -2.155900    
 C   -2.816900      -1.080300     -0.2770000    
 C   -2.802900       1.284300      0.2183000    
 C    1.678200      -2.371600       2.915000    
 C   -4.207500      -1.050100     -0.3816000    
 C   -4.193500       1.314400      0.1138000    
 C   -4.895800      0.1472000     -0.1860000    
 H    3.384300       1.365200      0.1050000    
 H    2.427700       2.448900       1.115600    
 H    2.049300      0.7923000       2.917200    
 H    3.114000     -0.3304000       2.081900    
 H   0.7287000       2.702000     -0.7147000    
 H    3.547600      -1.170800     -0.4355000    
 H   -1.126100      -1.874700      -2.014600    
 H   0.1861000     -0.9235000       2.948800    
 H    3.596400       3.154800      -1.675600    
 H    2.149600       3.911300      -2.324600    
 H    2.660300       4.277100     -0.6611000    
 H    3.031300      -2.857500      -2.182600    
 H   0.6999000      -3.188200      -2.946200    
 H    2.542500       1.122700      -2.231200    
 H   -2.345800      -2.055300     -0.3350000    
 H   -2.291900       2.221300      0.4167000    
 H    1.020900      -3.136200       3.314400    
 H    2.706000      -2.644100       2.702900    
 H   -4.756900      -1.963200     -0.5919000    
 H   -4.729400       2.247900      0.2587000    
 H   -5.978800      0.1698000     -0.2637000    


%chk=000030334-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000030334

0 1
O -0.423092 1.825208 1.545972
O 1.220588 1.941882 -1.858537
N -0.723570 -0.002999 0.045087
C 1.529462 0.483677 0.727496
C 2.436949 1.689075 0.329295
C 1.487482 -0.629651 -0.307041
C 0.037166 0.892857 0.836912
C 1.997577 -0.036500 2.141112
C 0.139471 -0.895724 -0.662994
C 1.849963 2.656384 -0.726599
C 2.527418 -1.362237 -0.896959
C -0.192628 -1.868271 -1.623767
C -2.156489 0.018203 -0.044865
C 1.214828 -1.211192 2.686335
C 2.903870 3.659770 -1.226143
C 2.213994 -2.357399 -1.860540
C 0.867003 -2.598461 -2.218673
C -2.893303 -1.187020 0.076122
C -2.832134 1.249151 -0.226608
C 1.751701 -2.407793 3.029729
C -4.302254 -1.158710 -0.003435
C -4.241726 1.268049 -0.292407
C -4.982321 0.067637 -0.187806
H 3.405764 1.284887 -0.031404
H 2.655420 2.283787 1.237198
H 1.896035 0.822602 2.835757
H 3.072196 -0.294314 2.075550
H 0.999533 3.198120 -0.278212
H 3.571843 -1.174699 -0.620003
H -1.228559 -2.046937 -1.924550
H 0.136798 -1.044314 2.835314
H 3.758934 3.136359 -1.697440
H 2.455529 4.334986 -1.974953
H 3.297158 4.273751 -0.394441
H 3.015646 -2.938710 -2.328551
H 0.633799 -3.360019 -2.971181
H 1.884645 1.329753 -2.269085
H -2.368788 -2.131545 0.254930
H -2.255504 2.173466 -0.309788
H 1.138297 -3.215299 3.444779
H 2.821799 -2.616154 2.902410
H -4.867550 -2.092493 0.090965
H -4.761179 2.222509 -0.430760
H -6.076174 0.087628 -0.243823


