%chk=000068573.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068573

0 1
 O    4.525000      -1.017900      -1.238800    
 O   -6.335400      6.4199999E-02  2.1299999E-02
 N    6.662700     -0.1199000       1.444900    
 C    2.169900     -0.4966000     -0.6539000    
 C    1.567500      0.7588000      1.5300000E-02
 C   5.9799999E-02  0.8850000     -0.2206000    
 C    3.685400     -0.2838000     -0.3504000    
 C  -0.6534000     -0.3595000      0.3883000    
 C    2.477900       1.886300     -0.4590000    
 C    1.496700      -1.729900     -2.9800000E-02
 C    3.874700       1.244000     -0.5524000    
 C  -3.8899999E-02  -1.678000     -0.1513000    
 C  -0.5278000       2.150100      0.4096000    
 C    1.944600     -0.5448000      -2.194200    
 C    4.133100     -0.6937000       1.058400    
 C   -2.169900     -0.2495000      0.2533000    
 C   -1.994700       2.293100      1.5100000E-02
 C   -2.787700       1.013500      0.1214000    
 C   -2.993600      -1.385500      0.3457000    
 C   -4.188200       1.102700      3.3399999E-02
 C    5.544000     -0.3715000       1.267000    
 C   -4.384100      -1.281800      0.2654000    
 C   -4.981600     -3.8500000E-02  0.1046000    
 C   -7.085900      -1.146800      0.1065000    
 H    1.702700      0.6886000       1.104900    
 H  -0.1408000      0.9347000      -1.298300    
 H  -0.4642000     -0.3528000       1.473100    
 H    2.477200       2.729700      0.2392000    
 H    2.167900       2.269200      -1.437800    
 H    1.733800      -1.800200       1.038400    
 H    1.872800      -2.650000     -0.4927000    
 H    4.315200       1.464200      -1.532500    
 H    4.534100       1.706500      0.1887000    
 H  -0.3433000      -1.834900      -1.192800    
 H  -0.4310000      -2.534300      0.4098000    
 H   1.3600000E-02   3.045300      8.4299996E-02
 H  -0.4378000       2.102600       1.502600    
 H    2.371700      -1.463300      -2.613700    
 H   0.8896000     -0.5331000      -2.477700    
 H    2.420500      0.2946000      -2.710900    
 H    4.020100      -1.777300       1.185600    
 H    3.535800     -0.2092000       1.836900    
 H   -2.052200       2.638100      -1.025300    
 H   -2.452100       3.067000      0.6435000    
 H    5.396200     -0.5881000      -1.272300    
 H   -2.571000      -2.375200      0.4898000    
 H   -4.661400       2.074700     -9.0400003E-02
 H   -4.936800      -2.212200      0.3403000    
 H   -6.957200      -1.631800       1.080100    
 H   -6.857500      -1.820800     -0.7261000    
 H   -8.143800     -0.8783000      2.0000000E-02


%chk=000068573-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068573

0 1
O 4.519814 -1.089114 -1.297482
O -6.399640 0.076835 0.065754
N 6.706624 -0.161455 1.559969
C 2.199139 -0.483322 -0.656981
C 1.587582 0.790578 0.010397
C 0.069862 0.906085 -0.221612
C 3.730551 -0.259794 -0.372273
C -0.626267 -0.357627 0.376629
C 2.516221 1.947737 -0.445276
C 1.527903 -1.733064 -0.035140
C 3.922915 1.279415 -0.619218
C -0.018591 -1.677459 -0.181822
C -0.552975 2.169539 0.410165
C 2.006396 -0.501503 -2.200014
C 4.133806 -0.672219 1.086060
C -2.156651 -0.269999 0.250277
C -2.030354 2.300746 -0.010402
C -2.812854 0.993436 0.109623
C -2.966283 -1.429190 0.326637
C -4.221628 1.049903 0.053404
C 5.550306 -0.387641 1.365347
C -4.376430 -1.379334 0.267863
C -5.008503 -0.121020 0.130768
C -7.249680 -1.111934 0.147918
H 1.714415 0.677966 1.112495
H -0.130647 0.945365 -1.313474
H -0.385142 -0.339983 1.466848
H 2.539742 2.771268 0.289600
H 2.163337 2.376545 -1.401926
H 1.760828 -1.790137 1.048200
H 1.916173 -2.658718 -0.502715
H 4.299177 1.419087 -1.648465
H 4.675119 1.712422 0.064951
H -0.316229 -1.801207 -1.240507
H -0.440458 -2.544150 0.361104
H 0.001278 3.075350 0.098775
H -0.473066 2.102218 1.515121
H 2.544375 -1.363675 -2.625929
H 0.942446 -0.580976 -2.476498
H 2.409998 0.405784 -2.681679
H 3.969874 -1.758271 1.207729
H 3.510865 -0.145928 1.832674
H -2.071315 2.639070 -1.067134
H -2.533910 3.088643 0.581971
H 5.480834 -0.865541 -1.193410
H -2.494943 -2.411199 0.438424
H -4.735219 2.012503 -0.050906
H -4.954153 -2.306323 0.331008
H -7.109988 -1.642897 1.110105
H -7.051818 -1.808794 -0.690191
H -8.280636 -0.734322 0.079737


