%chk=000119554.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119554

0 1
 O    3.076700      -2.003600       1.548800    
 O    4.595100      -1.616300      -1.690400    
 O   -5.465500      -1.748900     -0.1011000    
 O   -3.580300      -2.870600     -1.9600000E-02
 N   -4.215200      -1.792600     -5.9000000E-02
 C    2.196000     -0.3452000      0.1051000    
 C   6.2000002E-03  0.7605000      3.2900002E-02
 C   0.7720000     -0.4345000      7.1900003E-02
 C    3.073600      -1.586500      0.1828000    
 C   -1.414900      0.7130000     -1.1400000E-02
 C    2.818700      0.9208000      0.1312000    
 C   0.6489000       2.019800      4.4399999E-02
 C    4.528200      -1.379200     -0.2834000    
 C   -2.084400     -0.5303000     -1.0900000E-02
 C    2.044500       2.084500      0.1011000    
 C   -2.171700       1.909200     -5.3599998E-02
 C   6.3199997E-02  -1.655600      8.2800001E-02
 C    4.278000       1.047700      0.1995000    
 C   -1.332100      -1.704400      3.9600000E-02
 C    5.068200     -1.0600000E-02 -1.0200000E-02
 C  -0.1158000       3.193300      3.8999999E-03
 C   -1.507600       3.139500     -4.6599999E-02
 C   -3.486000     -0.5669000     -5.6499999E-02
 C   -3.572000       1.843800     -9.9600002E-02
 C   -4.224000      0.6132000     -0.1015000    
 H    2.633500      -2.389300     -0.4187000    
 H    5.184500      -2.110900      0.2028000    
 H    2.535900       3.057100      0.1181000    
 H   0.5896000      -2.606200      0.1313000    
 H    4.710300       2.025700      0.3829000    
 H   -1.650900      -2.731000      5.9300002E-02
 H    6.146600      0.1194000      2.0000001E-03
 H   0.3665000       4.168900      1.1600000E-02
 H   -2.066400       4.072600     -7.7600002E-02
 H   -4.168100       2.753500     -0.1331000    
 H   -5.310500      0.6251000     -0.1376000    
 H    3.553000      -2.850000       1.595600    
 H    4.358200      -2.547000      -1.842900    


%chk=000119554-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000119554

0 1
O 3.061441 -1.985215 1.631169
O 4.651314 -1.575056 -1.764451
O -5.635056 -1.691941 0.072280
O -3.791057 -2.970695 -0.271527
N -4.354295 -1.817725 -0.088058
C 2.232690 -0.335381 0.119337
C 0.007611 0.772797 0.039005
C 0.809693 -0.425663 0.086325
C 3.094242 -1.583282 0.203291
C -1.429764 0.696712 -0.012275
C 2.864805 0.941387 0.139750
C 0.662664 2.058286 0.055441
C 4.557156 -1.400469 -0.293718
C -2.097238 -0.592983 -0.019089
C 2.075791 2.113770 0.114778
C -2.196032 1.920877 -0.056803
C 0.111958 -1.688716 0.118373
C 4.331963 1.040154 0.173553
C -1.267540 -1.777208 0.061686
C 5.138229 -0.039692 -0.007561
C -0.135499 3.260990 0.011597
C -1.514811 3.193172 -0.045782
C -3.532555 -0.585667 -0.070421
C -3.615878 1.855423 -0.107101
C -4.273382 0.622637 -0.111081
H 2.652473 -2.390105 -0.422903
H 5.171874 -2.182295 0.210542
H 2.570257 3.092936 0.129981
H 0.689058 -2.612582 0.211648
H 4.768065 2.035252 0.324326
H -1.753390 -2.751565 0.074293
H 6.228357 0.056715 -0.024943
H 0.375674 4.230397 0.023681
H -2.118671 4.106644 -0.081154
H -4.195081 2.784127 -0.144341
H -5.363101 0.557770 -0.144174
H 3.597361 -2.814280 1.745434
H 4.502674 -2.531526 -1.987209


