%chk=000118610.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118610

0 1
 O    4.859400     -0.9082000     -0.2839000    
 O   -8.322600      0.9360000     -0.4328000    
 O   -8.612800      -1.152300      0.4910000    
 N    5.203700       1.247000      0.3270000    
 C    2.896200      0.3676000      2.8700000E-02
 C    4.331700      0.3044000      4.3900002E-02
 C   0.1037000      0.4909000     -3.0000001E-04
 C    6.207000     -0.7057000     -0.1963000    
 C    6.413800      0.6138000      0.1775000    
 C    2.146000     -0.7633000     -0.3054000    
 C    2.241600       1.560600      0.3482000    
 C   0.7525000     -0.7017000     -0.3199000    
 C   0.8482000       1.622100      0.3338000    
 C   -1.349300      0.5553000     -1.5699999E-02
 C   -3.651100     -0.4449000      6.3000001E-02
 C    7.217600      -1.629500     -0.4317000    
 C    7.728400       1.075300      0.3364000    
 C   -2.179000     -0.5122000      5.8899999E-02
 C    8.523100      -1.153600     -0.2689000    
 C    8.775900      0.1714000      0.1074000    
 C   -4.279700      0.6906000     -0.4218000    
 C   -4.378100      -1.518100      0.5523000    
 C   -6.419000     -0.3178000      7.2099999E-02
 C   -5.673100      0.7546000     -0.4172000    
 C   -5.771500      -1.454100      0.5567000    
 C   -7.871700     -0.2509000      7.7000000E-02
 C   -9.741200       1.122800     -0.4798000    
 H    2.614100      -1.709600     -0.5652000    
 H    2.800800       2.455300      0.6121000    
 H   0.2170000      -1.601500     -0.6080000    
 H   0.3606000       2.560400      0.5872000    
 H   -1.751700       1.563700     -5.8499999E-02
 H    7.011300      -2.651900     -0.7224000    
 H    7.935900       2.099600      0.6275000    
 H   -1.781200      -1.518600      0.1569000    
 H   -3.741000       1.538400     -0.8329000    
 H   -3.888500      -2.409800      0.9348000    
 H    9.359500      -1.827400     -0.4384000    
 H    9.803600      0.5065000      0.2244000    
 H   -6.134500       1.656800     -0.8090000    
 H   -6.333600      -2.300400      0.9427000    
 H   -10.20060      0.3619000      -1.117600    
 H   -9.940900       2.108800     -0.9077000    
 H   -10.16000       1.085100      0.5301000    


%chk=000118610-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000118610

0 1
O 5.062876 -1.088099 0.016011
O -8.576412 1.076480 -0.100842
O -8.805159 -1.243425 -0.066811
N 5.300526 1.224853 -0.015576
C 2.980157 0.252991 -0.014845
C 4.434576 0.214456 -0.005777
C 0.120126 0.378104 -0.034247
C 6.442397 -0.792066 0.019515
C 6.584258 0.626867 0.000242
C 2.203582 -0.940899 -0.002412
C 2.316351 1.510773 -0.037001
C 0.802645 -0.876507 -0.011986
C 0.914689 1.564869 -0.046550
C -1.341214 0.508798 -0.045507
C -3.720372 -0.378700 -0.043870
C 7.522163 -1.681835 0.037986
C 7.871463 1.205440 -0.000942
C -2.258270 -0.512921 -0.032399
C 8.807679 -1.087326 0.036590
C 8.977588 0.327104 0.017491
C -4.398066 0.878673 -0.069840
C -4.515958 -1.563806 -0.028542
C -6.576655 -0.245252 -0.065688
C -5.800016 0.945718 -0.080597
C -5.919104 -1.502413 -0.039314
C -8.063949 -0.228082 -0.076830
C -10.053710 1.173986 -0.113276
H 2.713086 -1.909020 0.014559
H 2.918521 2.424576 -0.046544
H 0.232051 -1.810917 -0.002221
H 0.413270 2.540142 -0.063814
H -1.707759 1.544825 -0.066704
H 7.384843 -2.766061 0.052472
H 7.996421 2.291623 -0.015700
H -1.893168 -1.549404 -0.011558
H -3.824003 1.810931 -0.081535
H -4.016621 -2.540066 -0.007957
H 9.692442 -1.732624 0.050490
H 9.991907 0.739850 0.017143
H -6.311962 1.911700 -0.100597
H -6.527704 -2.412455 -0.027701
H -10.462769 0.674226 -1.007515
H -10.264065 2.252613 -0.130162
H -10.476178 0.699682 0.788560


