%chk=000039152.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039152

1 1
 O    1.178900      -1.278600     -0.6282000    
 O   -1.275600      0.5269000      -2.245700    
 O  -0.5381000     -0.6266000       2.311600    
 O   0.6031000       5.135500     -0.3345000    
 O    1.965900      -3.349300      -1.274800    
 N    4.151800      -1.509600      0.2600000    
 C   -1.071600     -0.6764000     -9.8999999E-02
 C  -0.1368000      -1.796200     -0.5346000    
 C  -0.9739000      0.5111000      -1.066500    
 C  -0.6010000     -7.0699997E-02   1.230500    
 C   -2.480800      -1.157800      7.3000002E-03
 C  -0.4431000       1.664200     -0.3347000    
 C  -0.2267000       1.326700      0.9978000    
 C    3.477800      -1.468200      -1.061100    
 C  -0.1762000       2.931700     -0.8148000    
 C    2.149600      -2.168400      -1.012700    
 C    5.507900     -0.7925000      0.2033000    
 C    3.293800     -0.8230000       1.331700    
 C    4.397200      -2.959000      0.7021000    
 C   0.2659000       2.242200       1.907500    
 C   -3.500200     -0.2619000      0.3266000    
 C   -2.775300      -2.502600     -0.2125000    
 C   0.3240000       3.871000      9.0899996E-02
 C   0.5431000       3.529400       1.439300    
 C   -4.816800     -0.7119000      0.4265000    
 C   -4.091900      -2.952500     -0.1128000    
 C   -5.112700      -2.057100      0.2067000    
 C   0.3617000       5.423900      -1.709800    
 H  -0.4129000      -2.188200      -1.522300    
 H  -0.1133000      -2.608300      0.2036000    
 H    3.350300     -0.4237000      -1.369700    
 H    4.117200      -1.960400      -1.803300    
 H  -0.3681000       3.130900      -1.861500    
 H    5.977100     -0.8491000       1.189800    
 H    6.126500      -1.294400     -0.5465000    
 H    5.329500      0.2490000     -7.9499997E-02
 H    3.891600     -0.7420000       2.245100    
 H    3.022000      0.1732000      0.9710000    
 H    2.410200      -1.431600       1.538500    
 H    4.981900      -2.939400       1.627100    
 H    3.438700      -3.450500      0.8871000    
 H    4.954400      -3.469300     -8.9000002E-02
 H   0.4344000       1.982500       2.946300    
 H   -3.298000      0.7903000      0.5056000    
 H   -2.039000      -3.257200     -0.4628000    
 H   0.9323000       4.274700       2.128900    
 H   -5.611700     -1.5000000E-02  0.6760000    
 H   -4.323600      -4.000000     -0.2833000    
 H   -6.137700      -2.407500      0.2847000    
 H  -0.7006000       5.331900      -1.960400    
 H   0.9970000       4.819300      -2.366000    
 H   0.6384000       6.470500      -1.874100    


%chk=000039152-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039152

1 1
O 1.428817 -1.552789 -1.296236
O -1.206476 0.510230 -2.911450
O 0.876400 -0.363292 1.282792
O -0.595820 5.667510 -0.896708
O 1.778608 -3.371207 0.136713
N 4.330550 -2.183506 0.932988
C -0.710603 -0.479578 -0.666434
C -0.065953 -1.742345 -1.278189
C -0.895675 0.670117 -1.705888
C 0.144428 0.225233 0.429655
C -2.108667 -0.883907 -0.113412
C -0.608893 1.954772 -1.009480
C -0.001583 1.679932 0.246217
C 3.554750 -1.697474 -0.299698
C -0.834248 3.262810 -1.465670
C 2.161835 -2.327786 -0.435597
C 5.600618 -1.337730 1.035482
C 3.500139 -1.989526 2.213358
C 4.720904 -3.659158 0.786839
C 0.402302 2.745232 1.089046
C -2.274993 -1.219615 1.254954
C -3.211205 -1.001585 -0.998808
C -0.440200 4.326550 -0.607492
C 0.173784 4.060234 0.660575
C -3.533149 -1.648597 1.731985
C -4.465379 -1.437657 -0.516005
C -4.632356 -1.758312 0.849852
C -1.237757 6.049188 -2.170248
H -0.372782 -1.857053 -2.330191
H -0.294213 -2.647730 -0.694754
H 3.435182 -0.606009 -0.215762
H 4.161871 -1.920055 -1.194743
H -1.292689 3.430703 -2.443764
H 6.215827 -1.721051 1.863287
H 6.162316 -1.407604 0.091218
H 5.321302 -0.291583 1.232606
H 4.168702 -2.140363 3.074392
H 3.070240 -0.976417 2.216150
H 2.683263 -2.722522 2.218698
H 5.265717 -3.964891 1.693008
H 3.802324 -4.250565 0.671537
H 5.368409 -3.770532 -0.097159
H 0.865350 2.545760 2.060088
H -1.430128 -1.153443 1.948009
H -3.097517 -0.753892 -2.059513
H 0.450833 4.920600 1.276893
H -3.653436 -1.900238 2.791164
H -5.309567 -1.525329 -1.208026
H -5.606454 -2.091870 1.222619
H -2.268501 5.654039 -2.222229
H -0.643516 5.691288 -3.030695
H -1.256115 7.147015 -2.156575


