%chk=000008350.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008350

0 1
 O   8.2699999E-02   1.709700       2.196800    
 N    2.558200       1.144500      0.8752000    
 N   -3.649800       1.244700     -0.9835000    
 C    2.739500     -0.1634000      -1.365400    
 C    1.254500       1.178700      0.1595000    
 C    1.288000      0.2800000      -1.096600    
 C    3.226000      -1.033600     -0.1824000    
 C    3.613800       1.104200      -1.386800    
 C    2.969400     -0.2579000       1.131500    
 C    3.577300       1.770700     -1.0000000E-03
 C   7.8000002E-02  0.8325000       1.074900    
 C    2.595000      -2.393100     -0.1603000    
 C   -1.243600      0.9415000      0.3568000    
 C   -2.111600     -0.1453000      0.2451000    
 C    3.279600      -3.537600     -0.2595000    
 C   -1.564900       2.169000     -0.1912000    
 C   -3.325500      5.3800002E-02 -0.4454000    
 C   -1.805400      -1.401900      0.7943000    
 C   -2.774700       2.267300     -0.8482000    
 C   -4.197400      -1.025400     -0.5615000    
 C   -2.695800      -2.463700      0.6632000    
 C   -3.893200      -2.274800     -1.5600000E-02
 H    2.812100     -0.6984000      -2.318700    
 H    1.128900       2.220300     -0.1665000    
 H   0.9177000      0.8489000      -1.958900    
 H   0.6440000     -0.5994000      -1.002400    
 H    4.313700      -1.156400     -0.2907000    
 H    3.244300       1.800100      -2.149600    
 H    4.647100      0.8508000      -1.651100    
 H    2.244100     -0.7639000       1.778000    
 H    3.894900     -0.2468000       1.723600    
 H    4.564400       1.707900      0.4746000    
 H    3.373500       2.843500     -0.1072000    
 H   0.2488000     -0.1502000       1.500600    
 H    1.517300      -2.458400     -3.5700001E-02
 H  -0.7509000       1.586000       2.682200    
 H    2.763200      -4.490700     -0.2261000    
 H    4.357700      -3.547400     -0.3751000    
 H  -0.9264000       3.040400     -0.1084000    
 H  -0.8937000      -1.627600       1.332500    
 H   -3.089600       3.203800      -1.296600    
 H   -5.141900     -0.9033000      -1.088700    
 H   -2.456400      -3.434100       1.087500    
 H   -4.593700      -3.097900     -0.1229000    


%chk=000008350-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008350

0 1
O 0.126232 2.559784 1.888678
N 2.576892 1.018379 0.968200
N -3.751678 1.033358 -1.022177
C 2.662390 -0.115082 -1.366495
C 1.311876 1.320728 0.215116
C 1.233979 0.426839 -1.072067
C 3.062478 -1.161856 -0.272620
C 3.684895 1.055325 -1.300861
C 2.773570 -0.453598 1.115277
C 3.720216 1.582552 0.182159
C 0.079181 1.276128 1.159843
C 2.342856 -2.483403 -0.393497
C -1.252324 1.141183 0.419385
C -1.959930 -0.112480 0.294401
C 2.943936 -3.696968 -0.486804
C -1.822640 2.278653 -0.167057
C -3.215747 -0.109898 -0.438766
C -1.505398 -1.355725 0.852265
C -3.057922 2.179138 -0.876034
C -3.953946 -1.328545 -0.584555
C -2.248422 -2.528666 0.696976
C -3.481496 -2.518390 -0.028642
H 2.686518 -0.589686 -2.363654
H 1.384838 2.382486 -0.090333
H 0.863404 1.020856 -1.927294
H 0.529907 -0.415973 -0.950527
H 4.150993 -1.350826 -0.365565
H 3.376588 1.857696 -1.998398
H 4.684800 0.706805 -1.621604
H 1.871823 -0.887174 1.586160
H 3.611022 -0.626410 1.814283
H 4.655068 1.282206 0.689590
H 3.658648 2.684451 0.221137
H 0.203204 0.443376 1.880062
H 1.241119 -2.440898 -0.387294
H -0.551644 2.542440 2.611611
H 2.363899 -4.624109 -0.558007
H 4.036995 -3.797573 -0.498080
H -1.322310 3.246266 -0.066885
H -0.567510 -1.393112 1.416423
H -3.496621 3.070668 -1.340500
H -4.892541 -1.280245 -1.145114
H -1.886101 -3.465177 1.135264
H -4.051894 -3.446424 -0.143701


