%chk=000097597.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097597

0 1
 O   -5.614800      -1.257600      0.5467000    
 O   -6.184700       1.063100      0.2550000    
 O    1.512200      -3.204800     -0.4296000    
 O    4.954500       1.977600      0.3336000    
 O    5.719100     -0.6913000      0.2558000    
 N  -0.2632000      -1.699800     -0.4245000    
 C  -0.7477000     -0.3505000     -0.2142000    
 C   0.2275000      0.6833000     -0.2037000    
 C   -2.152400     -1.4600000E-02 -6.8800002E-02
 C    1.667500      0.3607000     -0.1104000    
 C   -2.533900       1.362500     -0.1555000    
 C    2.083900     -0.9734000     -0.1379000    
 C    1.095000      -2.049600     -0.3335000    
 C  -0.2138000       2.015400     -0.2766000    
 C   -3.216200     -0.9197000      0.2158000    
 C   -1.562600       2.345200     -0.2909000    
 C   -3.877100       1.777900     -8.1100002E-02
 C   -4.526000     -0.4806000      0.2953000    
 C    2.675200       1.334800      5.6400001E-02
 C   -4.850400      0.8344000      0.1362000    
 C    3.441600      -1.323000     -1.7000001E-02
 C   -1.146500      -2.759300     -0.8953000    
 C    4.026300      0.9927000      0.1763000    
 C    4.410000     -0.3385000      0.1397000    
 C   -6.667300     -0.2722000      0.5079000    
 C    5.531300       2.519800     -0.8526000    
 C    6.212500     -0.9324000       1.572900    
 H   0.4824000       2.847200     -0.3345000    
 H   -3.042700      -1.966900      0.4232000    
 H   -1.834700       3.397100     -0.3586000    
 H   -4.152000       2.825900     -0.1681000    
 H    2.433700       2.392900      0.1117000    
 H    3.756700      -2.363500     -4.6399999E-02
 H  -0.5884000      -3.479000      -1.505200    
 H   -1.934300      -2.366600      -1.542900    
 H   -1.539200      -3.309700     -3.6400001E-02
 H   -7.191300     -0.2800000       1.470500    
 H   -7.376400     -0.5457000     -0.2819000    
 H    6.252800       3.288400     -0.5623000    
 H    4.760300       2.981500      -1.477500    
 H    6.056400       1.742100      -1.416200    
 H    5.674900      -1.765300       2.036900    
 H    6.118400     -3.3300001E-02   2.190000    
 H    7.270900      -1.196800       1.498900    


%chk=000097597-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097597

0 1
O -5.657391 -1.371104 0.595747
O -6.318574 0.928147 0.382913
O 1.306958 -3.267839 -0.527452
O 4.936564 2.028332 0.247813
O 5.687288 -0.801452 0.308931
N -0.359711 -1.632492 -0.527867
C -0.799208 -0.300723 -0.285941
C 0.178082 0.737794 -0.201556
C -2.208323 0.019724 -0.105604
C 1.603205 0.396324 -0.127708
C -2.608522 1.419271 -0.126901
C 1.987300 -0.978760 -0.138825
C 0.995146 -2.042252 -0.378050
C -0.260216 2.101543 -0.174774
C -3.219846 -0.974952 0.174806
C -1.604883 2.438065 -0.199248
C -3.992172 1.800375 -0.000706
C -4.530815 -0.561635 0.311502
C 2.634660 1.371196 -0.011285
C -4.923208 0.801524 0.200012
C 3.345087 -1.356651 0.012886
C -1.214566 -2.665173 -1.172350
C 3.981610 0.999237 0.113172
C 4.343990 -0.388128 0.163813
C -6.821420 -0.448392 0.639534
C 5.983358 2.060836 -0.803530
C 6.294507 -0.461226 1.618605
H 0.485151 2.900604 -0.151668
H -2.971303 -2.022474 0.331671
H -1.915138 3.488197 -0.217975
H -4.276630 2.855237 -0.032641
H 2.422179 2.443118 -0.019271
H 3.603857 -2.419506 0.010366
H -0.579251 -3.228755 -1.873947
H -2.038908 -2.179643 -1.712889
H -1.610816 -3.395842 -0.445977
H -7.270622 -0.483463 1.646624
H -7.530521 -0.725282 -0.159203
H 6.669430 2.867334 -0.504359
H 5.524046 2.298773 -1.781423
H 6.515876 1.095445 -0.863648
H 5.765060 -0.995065 2.429999
H 6.259950 0.628429 1.800699
H 7.336241 -0.810294 1.556908


