%chk=000126686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126686

0 1
 O   -2.008400     -4.9600001E-02   1.293400    
 O   -3.328400      -1.978100     -0.1684000    
 O   0.3403000       1.909500       1.129800    
 O   0.9537000      -1.324200       1.311300    
 O    1.770000      -2.089200     -0.6604000    
 N  -0.6214000       1.285700     -0.8927000    
 N    3.807300     -0.2259000     -0.4491000    
 C   -1.995700       1.537500     -0.5271000    
 C   -2.680000      0.3182000      8.7899998E-02
 C    1.780700       1.148900     -0.6347000    
 C    2.517900      8.0100000E-02  0.1765000    
 C   0.4360000       1.495800     -2.3700001E-02
 C   -2.697100     -0.8922000     -0.8400000    
 C    1.725000      -1.216500      0.1973000    
 H   -2.521200       1.854000      -1.434000    
 H   -2.012200       2.368000      0.1878000    
 H   -3.705300      0.5794000      0.3720000    
 H    1.650600      0.8152000      -1.671700    
 H    2.366900       2.075600     -0.6709000    
 H    2.693700      0.4120000       1.206000    
 H  -0.4429000      0.9321000      -1.827700    
 H   -1.684900      -1.224500      -1.090000    
 H   -3.239300     -0.6845000      -1.767500    
 H    4.325200     -0.8784000      0.1387000    
 H    4.371700      0.6216000     -0.4968000    
 H   -1.121400     -0.3689000       1.056700    
 H   -4.239500      -1.705800      3.5200000E-02
 H   0.4513000      -2.166700       1.327200    


%chk=000126686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126686

0 1
O -2.503818 0.468066 1.298856
O -1.898768 -1.851965 0.562627
O -0.160275 1.774032 1.298379
O 0.587469 -1.700270 0.756795
O 1.062291 -1.327046 -1.493041
N -0.430369 1.192112 -0.933229
N 3.664681 -0.513575 -0.427524
C -1.889069 1.413539 -0.934898
C -2.727167 0.376383 -0.152727
C 1.856180 1.256453 -0.034560
C 2.408230 -0.231383 0.240977
C 0.360087 1.439982 0.172105
C -2.454515 -1.118258 -0.589433
C 1.315310 -1.183085 -0.258155
H -2.222348 1.419816 -1.988122
H -2.091870 2.415745 -0.510648
H -3.792822 0.616205 -0.326941
H 2.127635 1.497383 -1.077758
H 2.386093 1.945499 0.643524
H 2.513643 -0.365289 1.328295
H 0.008219 0.741296 -1.741820
H -1.714504 -1.184291 -1.406734
H -3.389220 -1.614677 -0.900144
H 3.604276 -0.676557 -1.434168
H 4.496022 -0.024296 -0.099486
H -1.689447 1.060578 1.481530
H -2.110547 -1.230904 1.345877
H -0.422797 -1.966390 0.545521


