%chk=000034176.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034176

0 1
 O  -0.5232000      0.7589000      0.9313000    
 N   -2.901600       2.076800     -2.8700000E-02
 C   -1.711300      2.5100000E-02  0.5400000    
 C   0.5974000     -0.1532000       1.086100    
 C   -1.200300      -1.299000      9.2100002E-02
 C   0.1464000      -1.408100      0.4170000    
 C   -2.435900      0.8175000     -0.5337000    
 C    1.785300      0.4804000      0.4536000    
 C   -1.874900      -2.342200     -0.5206000    
 C   0.8573000      -2.566300      0.1450000    
 C   -1.167200      -3.509700     -0.8127000    
 C   0.1911000      -3.621500     -0.4810000    
 C    3.066700      0.2097000      0.9395000    
 C    1.624400       1.348500     -0.6289000    
 C   -3.837500       1.894700       1.093400    
 C   -3.552600       2.872800      -1.082600    
 C    4.180700      0.8036000      0.3464000    
 C    2.738600       1.942200      -1.222100    
 C    4.016700       1.669800     -0.7343000    
 H   -2.309900     -0.1539000       1.438700    
 H   0.7369000     -0.3108000       2.161900    
 H   -3.267500      0.2271000     -0.9413000    
 H   -1.743000      0.9971000      -1.366700    
 H   -2.928800      -2.265200     -0.7651000    
 H    1.904700      -2.662100      0.4096000    
 H   -1.673300      -4.341900      -1.294400    
 H   0.7264000      -4.539200     -0.7085000    
 H    3.208500     -0.4638000       1.780700    
 H   0.6464000       1.573100      -1.043900    
 H   -4.645500       1.195000      0.8512000    
 H   -4.295700       2.853300       1.366300    
 H   -3.326100       1.560200       2.000700    
 H   -2.858800       3.048500      -1.912100    
 H   -3.838800       3.858500     -0.6993000    
 H   -4.447200       2.377700      -1.477100    
 H    5.176000      0.5912000      0.7259000    
 H    2.611600       2.614200      -2.065900    
 H    4.884200       2.131500      -1.196700    


%chk=000034176-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034176

0 1
O -0.426111 0.882424 0.898805
N -3.281336 2.015481 0.167902
C -1.684211 0.121221 0.626470
C 0.716640 -0.067700 1.025685
C -1.197904 -1.246323 0.174721
C 0.193951 -1.354786 0.391468
C -2.523393 0.890286 -0.414099
C 1.963504 0.518194 0.379856
C -1.922738 -2.324084 -0.371558
C 0.890559 -2.532207 0.062486
C -1.229444 -3.513674 -0.704818
C 0.167008 -3.616414 -0.491790
C 3.218029 0.393841 1.023771
C 1.895652 1.157731 -0.882458
C -4.503983 1.586697 0.869629
C -3.533055 3.107586 -0.790225
C 4.393346 0.886963 0.411337
C 3.065663 1.657532 -1.492694
C 4.319946 1.519398 -0.850288
H -2.250709 0.042851 1.579254
H 0.920144 -0.237824 2.106411
H -3.199601 0.164448 -0.939264
H -1.819466 1.283595 -1.169459
H -3.003723 -2.251236 -0.537595
H 1.972778 -2.604082 0.218612
H -1.776751 -4.360106 -1.134640
H 0.690784 -4.540426 -0.760991
H 3.275300 -0.081223 2.011648
H 0.919867 1.277368 -1.364990
H -5.265344 1.123520 0.188115
H -4.971696 2.455446 1.365935
H -4.259708 0.847980 1.653560
H -2.574199 3.466270 -1.203508
H -4.013751 3.953737 -0.266532
H -4.195747 2.815404 -1.645762
H 5.358771 0.787091 0.920181
H 3.003295 2.157019 -2.466343
H 5.227834 1.908504 -1.325032


