%chk=000006148.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006148

0 1
 O  -0.1769000      -1.077300      0.8034000    
 O   0.8583000      -1.849100      -1.108800    
 N   -3.174000      0.6861000      0.1762000    
 C  -0.2130000      0.2504000      0.2539000    
 C  -0.9461000       1.154000       1.290100    
 C   -1.042000      0.1745000      -1.053300    
 C   -2.512700     -0.2108000     -0.7907000    
 C   -2.425200      0.7297000       1.441200    
 C    1.205700      0.7480000     -4.2399999E-02
 C  -0.2807000       1.132500       2.674900    
 C   -3.278400     -0.3361000      -2.113100    
 C   -3.457400       2.028600     -0.3290000    
 C    1.426000       1.613800      -1.109800    
 C    2.265800      0.3311000      0.7574000    
 C   0.3911000      -2.033800      6.6000000E-03
 C    2.717400       2.066500      -1.379600    
 C    3.557200      0.7838000      0.4876000    
 C   0.3514000      -3.362200      0.7252000    
 C    3.783100       1.651600     -0.5809000    
 C   0.9500000      -4.481400     -0.1087000    
 H  -0.9172000       2.193900      0.9375000    
 H  -0.6391000     -0.4820000      -1.826900    
 H   -1.090300       1.156900      -1.534200    
 H   -2.528300      -1.217800     -0.3518000    
 H   -2.479000     -0.2634000       1.907500    
 H   -2.935000       1.400100       2.145500    
 H   0.7152000       1.583100       2.650700    
 H  -0.8701000       1.718700       3.389100    
 H  -0.1957000      0.1170000       3.074700    
 H   -3.227000      0.5802000      -2.710200    
 H   -2.857400      -1.145700      -2.719900    
 H   -4.332500     -0.5751000      -1.934700    
 H   -2.565200       2.572200     -0.6532000    
 H   -3.950800       2.629300      0.4441000    
 H   -4.162500       1.994400      -1.165600    
 H   0.6421000       2.000200      -1.747900    
 H    2.118500     -0.3360000       1.601800    
 H    2.893300       2.748200      -2.206700    
 H    4.386700      0.4629000       1.110900    
 H   0.9122000      -3.265900       1.660800    
 H  -0.6927000      -3.600000      0.9548000    
 H    4.788300       2.006000     -0.7896000    
 H    1.997800      -4.273900     -0.3506000    
 H   0.9055000      -5.429000      0.4366000    
 H   0.4066000      -4.602600      -1.051700    


%chk=000006148-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000006148

0 1
O -0.117755 -1.092986 0.713071
O 0.784093 -2.129680 -1.192687
N -3.177654 0.622298 0.155461
C -0.171235 0.300739 0.108456
C -0.896420 1.139499 1.218750
C -1.052663 0.276360 -1.170896
C -2.501998 -0.215672 -0.883856
C -2.365246 0.634613 1.395068
C 1.259632 0.807137 -0.136532
C -0.169281 1.153062 2.578278
C -3.322295 -0.320530 -2.180838
C -3.611509 1.965773 -0.280136
C 1.498477 1.884120 -1.028714
C 2.362323 0.276844 0.581340
C 0.362478 -2.185295 -0.017064
C 2.799198 2.405763 -1.207495
C 3.663516 0.791558 0.400871
C 0.289353 -3.439159 0.847699
C 3.890588 1.860608 -0.495524
C 0.784323 -4.699090 0.116381
H -0.925387 2.177102 0.824996
H -0.568471 -0.347508 -1.940082
H -1.116838 1.306961 -1.569395
H -2.439958 -1.232386 -0.444127
H -2.328837 -0.395568 1.798839
H -2.873615 1.269541 2.145459
H 0.844574 1.580985 2.499124
H -0.738669 1.762814 3.304547
H -0.081608 0.129920 2.984793
H -3.332826 0.629479 -2.746629
H -2.888978 -1.094158 -2.839663
H -4.365446 -0.602643 -1.951659
H -2.796712 2.640294 -0.646441
H -4.099715 2.469917 0.573334
H -4.360125 1.878168 -1.085543
H 0.673116 2.322444 -1.599395
H 2.200615 -0.546006 1.285294
H 2.958870 3.234426 -1.906774
H 4.500065 0.357955 0.960603
H 0.879767 -3.253335 1.766132
H -0.757475 -3.556851 1.188445
H 4.900673 2.260604 -0.637732
H 1.831822 -4.581123 -0.209403
H 0.719242 -5.578727 0.780961
H 0.180989 -4.896667 -0.786119


