%chk=000097831.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097831

0 1
 O    3.235100      -1.148900     -0.8410000    
 N   0.4099000      0.9990000     -0.1278000    
 N   0.5137000      -1.217400      2.3000001E-03
 C    1.211700     -0.1076000     -9.0899996E-02
 C  -0.8923000      0.5754000     -5.3199999E-02
 C    2.684800     -1.3200000E-02 -0.1535000    
 C  -0.8008000     -0.8115000      2.7200000E-02
 C   0.8508000       2.372200     -0.2271000    
 C   -2.105200       1.265000     -4.9100000E-02
 C    3.347600      6.5600000E-02   1.231200    
 C   -1.979200      -1.571400      0.1174000    
 C   -3.268000      0.4929000      4.1499998E-02
 C   -3.208300     -0.9002000      0.1232000    
 H    2.999000      0.8621000     -0.7325000    
 H    1.634600       2.548700      0.5131000    
 H    1.229500       2.536900      -1.239000    
 H   2.1199999E-02   3.053000     -2.7799999E-02
 H   -2.160800       2.345300     -0.1144000    
 H    3.130100     -0.8350000       1.816900    
 H    2.999700      0.9357000       1.795900    
 H    4.436600      0.1223000       1.128900    
 H   -1.943500      -2.654300      0.1814000    
 H   -4.236400      0.9873000      4.7600001E-02
 H   -4.129400      -1.473200      0.1924000    
 H    2.873800      -1.145100      -1.744300    


%chk=000097831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097831

0 1
O 3.213701 -1.398885 -0.664380
N 0.441143 1.070315 -0.105484
N 0.565107 -1.209051 -0.233069
C 1.263181 -0.059327 -0.198401
C -0.887565 0.601235 -0.069192
C 2.778635 -0.072366 -0.232033
C -0.792251 -0.829525 -0.154603
C 0.843648 2.478389 -0.064278
C -2.123203 1.273710 0.018172
C 3.401136 0.258579 1.145871
C -1.964685 -1.616649 -0.152855
C -3.283999 0.469503 0.018785
C -3.205863 -0.951479 -0.065404
H 3.144853 0.655911 -0.985353
H 1.907824 2.570731 -0.330367
H 0.252892 3.062232 -0.791859
H 0.693390 2.908065 0.943064
H -2.193211 2.364480 0.086688
H 3.022889 -0.442697 1.909197
H 3.175813 1.292992 1.467613
H 4.495744 0.142048 1.075539
H -1.901032 -2.706981 -0.218431
H -4.267261 0.947796 0.086943
H -4.131919 -1.536480 -0.061105
H 2.405234 -1.988946 -0.606657


