%chk=000055170.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055170

0 1
 O   -1.433100      0.5258000      0.3002000    
 O   8.2900003E-02   1.209200      -1.295800    
 N    1.952800     -0.5303000     -0.3801000    
 N   -4.647400       2.328900      0.1636000    
 C   0.6579000     -0.5646000      0.2684000    
 C   7.1500003E-02  -1.954000      0.1681000    
 C  -0.2290000      0.5002000     -0.3474000    
 C   -3.655700       1.369600      0.6263000    
 C   -2.383300       1.472300     -0.1995000    
 C    2.903700      0.4443000     -0.1372000    
 C  -0.7534000      -2.265800     -0.8998000    
 C   0.3711000      -2.888200       1.145900    
 C   -1.294200      -3.548300     -0.9926000    
 C  -0.1697000      -4.170700       1.053100    
 C    4.147600      0.4238000     -0.7982000    
 C    2.656100       1.486800      0.7773000    
 C   -4.978100       2.094500      -1.244200    
 C   -5.858300       2.259700      0.9853000    
 C   -1.002300      -4.500600     -1.6100001E-02
 C    5.106300       1.407100     -0.5541000    
 C    3.614700       2.470100       1.021400    
 C    4.839900       2.430200      0.3556000    
 H   0.7536000     -0.3293000       1.336600    
 H    2.153900      -1.210500      -1.105600    
 H   -4.034400      0.3389000      0.5929000    
 H   -3.401200       1.562500       1.676600    
 H   -1.958800       2.481100     -0.1284000    
 H   -2.556500       1.221900      -1.250700    
 H  -0.9836000      -1.553100      -1.685600    
 H    1.020200      -2.641800       1.981100    
 H   -1.939000      -3.807000      -1.827500    
 H   5.8300000E-02  -4.912500       1.812800    
 H    4.372200     -0.3667000      -1.511000    
 H    1.721400       1.572100       1.322900    
 H   -5.831200       2.715900      -1.543400    
 H   -5.243000       1.049800      -1.444100    
 H   -4.164500       2.396800      -1.910500    
 H   -5.621900       2.462800       2.035800    
 H   -6.579700       3.023600      0.6743000    
 H   -6.343700       1.279000      0.9236000    
 H   -1.422200      -5.499500     -8.9100003E-02
 H    6.060200       1.376200      -1.072500    
 H    3.407800       3.267700       1.729000    
 H    5.586200       3.196100      0.5455000    


%chk=000055170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055170

0 1
O -1.355431 0.565943 0.180928
O -0.372446 0.225132 -1.907224
N 1.954366 -0.694970 -0.279739
N -4.462528 2.666026 0.152619
C 0.566240 -0.898498 0.121367
C 0.168369 -2.364545 -0.077507
C -0.405329 0.014674 -0.676405
C -3.415425 1.744237 0.648710
C -2.394123 1.435679 -0.452351
C 2.687545 0.466939 -0.003622
C 0.056986 -2.907815 -1.383894
C -0.058208 -3.198356 1.043767
C -0.266737 -4.271663 -1.559544
C -0.387752 -4.560980 0.866497
C 4.032758 0.570787 -0.466352
C 2.138759 1.546682 0.749136
C -5.443308 2.011698 -0.739215
C -5.124672 3.411065 1.243013
C -0.489420 -5.101712 -0.436150
C 4.801491 1.714752 -0.181331
C 2.925442 2.684393 1.031536
C 4.258344 2.783493 0.573446
H 0.439684 -0.636528 1.188671
H 2.358355 -1.386321 -0.910542
H -3.835342 0.786059 1.045317
H -2.883679 2.236168 1.483331
H -1.914218 2.358512 -0.820493
H -2.824459 0.892606 -1.311901
H 0.199721 -2.257517 -2.255185
H 0.028433 -2.782212 2.054347
H -0.352889 -4.684144 -2.570998
H -0.561797 -5.198128 1.740609
H 4.467844 -0.252007 -1.048089
H 1.104951 1.509290 1.107966
H -6.147952 2.768099 -1.127530
H -6.038060 1.214475 -0.224325
H -4.936967 1.554516 -1.606410
H -4.369983 3.960889 1.832455
H -5.823620 4.150535 0.812718
H -5.705059 2.757504 1.942899
H -0.743625 -6.158529 -0.574421
H 5.832608 1.772353 -0.549168
H 2.485564 3.503964 1.612056
H 4.859673 3.671456 0.793907


