%chk=000025110.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025110

0 1
 O    5.472900      0.5813000      0.2149000    
 O    3.530700       2.452400     -0.4158000    
 O    4.740000      -2.044800      0.7020000    
 O   -2.601900      -1.807300     -0.2267000    
 N   -3.290700      0.4197000      5.4299999E-02
 C    1.481000     -0.5452000      7.9999998E-04
 C    4.162400      0.2115000      0.1447000    
 C    3.187000       1.156700     -0.1728000    
 C    3.797100      -1.112000      0.3905000    
 C    1.846400      0.7783000     -0.2448000    
 C    2.456400      -1.490400      0.3186000    
 C   8.3099999E-02 -0.9397000     -7.4100003E-02
 C  -0.9709000     -9.6900001E-02  1.0500000E-02
 C   -4.703600      0.3208000      2.7899999E-02
 C   -2.371400     -0.6141000     -6.9600001E-02
 C   -5.464300       1.468900      0.1681000    
 C   -5.291600     -0.9216000     -0.1369000    
 C    6.057000       1.121100     -0.9682000    
 C    3.552900       3.337500      0.7024000    
 C    5.330500      -2.756800     -0.3835000    
 C   -6.855400       1.371600      0.1425000    
 C   -6.682800      -1.018800     -0.1623000    
 C   -7.464900      0.1278000     -2.2600001E-02
 H    1.119600       1.538900     -0.5162000    
 H    2.183200      -2.525200      0.5142000    
 H  -9.4099998E-02  -2.005900     -0.1982000    
 H  -0.8464000      0.9696000      0.1618000    
 H   -2.934900       1.365200      0.1793000    
 H   -4.999900       2.442400      0.2973000    
 H   -4.757900      -1.853200     -0.2510000    
 H    6.037000       2.213900     -0.9315000    
 H    5.562300      0.7606000      -1.877000    
 H    7.103300      0.8033000      -1.001900    
 H    4.273700       2.994900       1.451600    
 H    2.556200       3.416500       1.148000    
 H    3.858300       4.326500      0.3501000    
 H    5.842800      -2.069500      -1.064000    
 H    4.570000      -3.326200     -0.9271000    
 H    6.065200      -3.456000      2.5000000E-02
 H   -7.464400       2.264300      0.2514000    
 H   -7.158700      -1.986700     -0.2908000    
 H   -8.548100      5.2099999E-02 -4.2399999E-02


%chk=000025110-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025110

0 1
O 5.522373 0.448694 -0.409924
O 3.557028 2.552181 -0.162809
O 4.582046 -2.295735 -0.397726
O -2.765899 -1.818545 0.002433
N -3.523866 0.412511 -0.040916
C 1.358587 -0.460162 -0.130870
C 4.147410 0.152447 -0.271829
C 3.173699 1.190734 -0.149319
C 3.712629 -1.203400 -0.249544
C 1.803132 0.892020 -0.096350
C 2.332194 -1.493385 -0.182997
C -0.058787 -0.839014 -0.091877
C -1.144009 -0.007483 -0.077678
C -4.934856 0.249436 -0.002950
C -2.521398 -0.570655 -0.035554
C -5.729230 1.429970 -0.023215
C -5.568612 -1.022464 0.054333
C 5.869205 1.104399 -1.698334
C 4.423989 2.970484 0.964704
C 5.754847 -2.363361 0.503086
C -7.134768 1.344272 0.013428
C -6.977966 -1.089201 0.090436
C -7.770535 0.081494 0.070601
H 1.102505 1.728556 -0.020264
H 2.029110 -2.545537 -0.192492
H -0.284634 -1.915382 -0.075393
H -1.027207 1.084889 -0.100424
H -3.199149 1.381808 -0.078153
H -5.243686 2.414141 -0.068181
H -4.953253 -1.923533 0.069157
H 5.318329 2.055375 -1.806483
H 5.633672 0.426961 -2.539046
H 6.953327 1.287633 -1.650404
H 5.352671 2.373367 0.992392
H 3.877477 2.864509 1.920915
H 4.651086 4.031054 0.778375
H 5.419907 -2.437845 1.555549
H 6.404840 -1.483192 0.372631
H 6.280211 -3.285643 0.212745
H -7.732503 2.262388 -0.002970
H -7.459618 -2.072580 0.134618
H -8.863198 0.013294 0.098800


