%chk=000166449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166449

0 1
 O    3.217400      -1.492100      0.2976000    
 O   0.6674000      -2.503100      0.2593000    
 N   -1.193200       1.743600     -8.9900002E-02
 C   2.1800000E-02   1.106700      6.0000003E-04
 C  -0.2342000     -0.2625000      7.8199998E-02
 C   -1.654300     -0.4347000      3.1399999E-02
 C    1.317100       1.636700      1.9099999E-02
 C   -2.224400      0.8343000     -7.3500000E-02
 C    2.383300      0.7391000      0.1202000    
 C   0.8589000      -1.148500      0.1797000    
 C    2.159900     -0.6334000      0.1994000    
 C   -2.508500      -1.556900      6.8899997E-02
 C    1.565600       3.107600     -6.5399997E-02
 C   -3.607100       1.039500     -0.1431000    
 C    3.788100       1.257300      0.1444000    
 C   -3.893400      -1.367500      9.9999997E-05
 C   -4.432300     -8.7499999E-02 -0.1043000    
 C    3.768000      -1.978800     -0.9229000    
 H   -1.320700       2.743500     -0.1574000    
 H   -2.133800      -2.572100      0.1379000    
 H    1.956500       3.483000      0.8859000    
 H    2.278300       3.336900     -0.8647000    
 H   0.6558000       3.672400     -0.2887000    
 H   -4.027600       2.036300     -0.2246000    
 H    3.881600       2.123300      0.8079000    
 H    4.506300      0.5238000      0.5243000    
 H    4.100600       1.543500     -0.8652000    
 H   -4.554400      -2.229700      2.5900001E-02
 H   -5.510800      3.8100000E-02 -0.1571000    
 H  -0.2430000      -2.684200      0.5322000    
 H    4.104100      -1.153900      -1.558900    
 H    3.032800      -2.587200      -1.459100    
 H    4.630400      -2.606700     -0.6828000    


%chk=000166449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166449

0 1
O 3.409134 -1.348342 0.198352
O 0.836003 -2.493635 0.195314
N -1.196781 1.817886 -0.016321
C 0.058297 1.177875 0.011191
C -0.165832 -0.235393 0.027129
C -1.610623 -0.450641 -0.001760
C 1.341021 1.770060 0.023411
C -2.217985 0.857801 -0.022259
C 2.458218 0.889539 0.043002
C 0.958310 -1.091835 0.097513
C 2.260052 -0.531137 0.078488
C -2.453523 -1.590549 -0.033159
C 1.468015 3.283517 0.010251
C -3.615970 1.037323 -0.052230
C 3.880624 1.423983 0.050621
C -3.854493 -1.418093 -0.061717
C -4.428406 -0.117444 -0.067479
C 3.590472 -2.381793 -0.842628
H -1.336676 2.824714 -0.036003
H -2.050503 -2.611197 -0.059887
H 0.938186 3.741343 0.869885
H 2.516938 3.611092 0.064949
H 1.037094 3.720400 -0.913409
H -4.062965 2.037478 -0.065901
H 4.080994 2.027012 0.956643
H 4.595376 0.588207 0.038547
H 4.077230 2.070539 -0.825282
H -4.508769 -2.295944 -0.087151
H -5.518404 -0.009417 -0.090415
H -0.093673 -2.736856 0.426283
H 3.623740 -1.918895 -1.848731
H 2.781161 -3.129211 -0.797648
H 4.559938 -2.851588 -0.614199


