%chk=000130466.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130466

0 1
 O   -5.530000       1.372800      0.1704000    
 O  -0.9677000      -1.037100      -1.594900    
 O   0.6915000       1.522500     -0.2072000    
 O    3.415700       1.909100     -6.4300001E-02
 O    5.127500     -0.2618000     -0.2076000    
 N   -3.428900     -0.5435000      4.8599999E-02
 C   -4.833700     -0.9300000     -0.1425000    
 C   -3.345300      0.6339000      0.9240000    
 C   -2.655200      -1.654800      0.5983000    
 C   -5.622700      0.2487000     -0.7054000    
 C   -4.170000       1.775800      0.3367000    
 C   -1.199200      -1.309800      0.7512000    
 C  -0.4150000      -1.067500     -0.4993000    
 C    1.044000     -0.8341000     -0.4209000    
 C  -0.5769000      -1.314800       1.939600    
 C    1.533700      0.4514000     -0.2771000    
 C    1.887500      -1.928700     -0.4945000    
 C    2.912500      0.6497000     -0.2044000    
 C    3.778700     -0.4412000     -0.2770000    
 C    3.266200      -1.730300     -0.4220000    
 C   0.3433000       2.151700      -1.437800    
 C    3.023600       2.637000       1.097100    
 C    5.720300     -0.2992000       1.088900    
 H   -4.905300      -1.771300     -0.8412000    
 H   -5.276800      -1.241500      0.8124000    
 H   -3.722000      0.3918000       1.926500    
 H   -2.316600      0.9960000       1.023800    
 H   -3.075900      -1.979800       1.560000    
 H   -2.727200      -2.521200     -7.2700001E-02
 H   -5.268800      0.5325000      -1.704100    
 H   -6.680600     -1.8700000E-02 -0.7927000    
 H   -4.158600       2.632800       1.017800    
 H   -3.767000       2.112200     -0.6264000    
 H   0.4766000      -1.105900       2.079000    
 H   -1.134700      -1.530500       2.846500    
 H    1.496200      -2.935700     -0.6081000    
 H    3.935200      -2.584700     -0.4799000    
 H  -6.2700003E-02   1.431600      -2.154000    
 H    1.216800       2.651200      -1.868300    
 H  -0.4216000       2.905200      -1.230900    
 H    2.197100       3.311000      0.8556000    
 H    2.747700       1.977500       1.927600    
 H    3.874600       3.246600       1.415200    
 H    5.307500      0.4890000       1.726100    
 H    6.795200     -0.1321000      0.9789000    
 H    5.564000      -1.278000       1.553500    


%chk=000130466-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000130466

0 1
O -5.304564 1.718504 -0.479500
O -0.845342 -2.403571 -1.202572
O 0.642985 1.088956 0.584039
O 3.336706 1.689633 0.392138
O 5.200305 -0.419929 -0.503575
N -3.336398 -0.347295 0.062241
C -4.526618 -0.620395 -0.786017
C -3.627078 0.716618 1.056070
C -2.779484 -1.577801 0.691539
C -4.986338 0.675337 -1.471464
C -4.117835 1.989263 0.346621
C -1.286914 -1.430620 0.944203
C -0.400367 -1.683276 -0.250557
C 1.027695 -1.218531 -0.282308
C -0.767014 -1.209621 2.182925
C 1.499454 0.057129 0.139788
C 1.977599 -2.130833 -0.823223
C 2.887967 0.384105 0.102283
C 3.822056 -0.581217 -0.383772
C 3.342181 -1.828590 -0.865503
C -0.321844 1.592178 -0.423724
C 3.094655 2.180709 1.766651
C 5.931257 0.639367 0.215644
H -4.250784 -1.367608 -1.552723
H -5.374774 -1.032305 -0.183812
H -4.407857 0.382523 1.785757
H -2.704954 0.941229 1.624986
H -3.309960 -1.829598 1.640767
H -2.921995 -2.411841 -0.018365
H -4.186993 1.039544 -2.152723
H -5.916494 0.517106 -2.041494
H -4.433765 2.752937 1.076592
H -3.306726 2.400390 -0.293257
H 0.310589 -1.118784 2.351522
H -1.416390 -1.128691 3.063562
H 1.610145 -3.093245 -1.191810
H 4.075580 -2.541069 -1.253072
H -1.144157 0.870834 -0.587708
H 0.199184 1.812547 -1.373447
H -0.724229 2.522840 0.007501
H 2.015382 2.177689 1.989418
H 3.642670 1.556216 2.500572
H 3.489593 3.208294 1.780163
H 5.678771 1.635516 -0.177379
H 6.991260 0.400277 0.037559
H 5.715838 0.602881 1.299963


