%chk=000033617.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033617

1 1
 O   0.6494000       1.282300      0.1473000    
 O    3.127500     -0.3848000      -1.015600    
 N   -2.198200      0.6890000     -8.8900000E-02
 C   -1.175800     -0.3267000      3.4000000E-03
 C    2.481100     -0.3128000      0.2458000    
 C   0.1607000      5.0000002E-04  0.1218000    
 C    2.026600       1.120700      0.5901000    
 C    1.150700     -0.9682000      0.1998000    
 C   -3.545700      0.2089000      0.5234000    
 C   -2.469700       1.103000      -1.564200    
 C   -1.874100       2.026400      0.6504000    
 C   -1.513400      -1.681100     -1.8999999E-02
 C   0.8304000      -2.313500      0.1710000    
 C    2.867500       2.224700     -3.1599998E-02
 C  -0.5171000      -2.668300      6.6100001E-02
 H    3.134800     -0.7285000       1.019000    
 H    2.012900       1.249200       1.681800    
 H   -3.357200     -0.1468000       1.541200    
 H   -4.239200       1.056000      0.5435000    
 H   -3.980400     -0.5636000     -0.1167000    
 H   -2.794700      0.2120000      -2.109800    
 H   -3.255500       1.864100      -1.568300    
 H   -1.540400       1.497400      -1.986200    
 H   -1.165900       2.612600      6.0500000E-02
 H   -2.797500       2.610300      0.7282000    
 H   -1.504800       1.786500       1.652000    
 H   -2.533300      -2.034000     -0.1278000    
 H    1.600000      -3.076100      0.2189000    
 H    3.918000       2.137700      0.2609000    
 H    2.795800       2.214700      -1.124500    
 H    2.497600       3.204500      0.2900000    
 H  -0.7968000      -3.718000      3.6899999E-02
 H    4.014300      3.9999999E-04 -0.9124000    


%chk=000033617-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000033617

1 1
O 0.627369 1.333639 0.129159
O 3.029147 -0.576157 -1.140667
N -2.280578 0.730540 0.003528
C -1.219724 -0.346197 0.162625
C 2.509383 -0.256750 0.193632
C 0.143087 0.025015 0.208333
C 2.140995 1.254755 0.392352
C 1.161009 -0.947272 0.312261
C -3.694876 0.157276 -0.039251
C -2.035560 1.491448 -1.313069
C -2.201603 1.711676 1.186752
C -1.540504 -1.721080 0.250852
C 0.844212 -2.310935 0.384823
C 2.836393 2.251063 -0.520286
C -0.519839 -2.692027 0.367817
H 3.225800 -0.571303 0.977482
H 2.242595 1.524188 1.460569
H -3.909353 -0.368680 0.902263
H -4.394596 0.997917 -0.159622
H -3.791291 -0.526452 -0.894925
H -2.110437 0.775159 -2.144534
H -2.799878 2.278264 -1.410076
H -1.029835 1.932686 -1.281062
H -1.197999 2.158016 1.203368
H -2.967793 2.490208 1.047797
H -2.386818 1.150378 2.114551
H -2.577876 -2.063498 0.229559
H 1.633425 -3.066376 0.439563
H 3.914131 2.299103 -0.278679
H 2.727340 1.955830 -1.575920
H 2.422157 3.262973 -0.378261
H -0.795959 -3.747895 0.433604
H 4.005074 -0.407011 -1.177538


