%chk=000039486.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039486

0 1
 O    4.777900       1.442300      7.6000001E-03
 N    5.999600     -0.5454000      9.6000001E-02
 C    7.196000     -7.3500000E-02  0.7283000    
 C    7.135800     -0.2719000     -0.7337000    
 C  -0.1858000      0.3556000     -6.6900000E-02
 C    1.055400     -0.5385000     -3.1099999E-02
 C   -1.469500     -0.4768000     -2.9100001E-02
 C    2.368700      0.2473000     -3.5500001E-02
 C    3.606000     -0.6416000      2.6000001E-02
 C   -2.711800      0.4130000     -9.8800004E-02
 C    4.842600      0.2158000      4.0399998E-02
 C   -3.995000     -0.4164000     -2.7400000E-02
 C   -5.237700      0.4763000     -6.3900001E-02
 C   -6.519200     -0.3535000      4.1600000E-02
 C   -7.792900      0.4945000      3.3900000E-02
 C   -9.070100     -0.3271000      0.1127000    
 H    7.678200     -0.8211000       1.341000    
 H    7.149800      0.9296000       1.126800    
 H    7.040300      0.5888000      -1.379700    
 H    7.574600      -1.160500      -1.162800    
 H  -0.1680000       1.043400      0.7872000    
 H  -0.1680000      0.9680000     -0.9765000    
 H    1.039900      -1.215700     -0.8940000    
 H    1.020200      -1.168500      0.8665000    
 H   -1.476800      -1.181700     -0.8693000    
 H   -1.493000      -1.071400      0.8923000    
 H    2.404900      0.8701000     -0.9388000    
 H    2.367500      0.9371000      0.8187000    
 H    3.591200      -1.257300      0.9323000    
 H    3.643700      -1.306700     -0.8439000    
 H   -2.693700       1.131900      0.7293000    
 H   -2.698900      0.9920000      -1.030200    
 H   -4.024100      -1.123100     -0.8656000    
 H   -3.997000      -1.009000      0.8956000    
 H   -5.200000       1.194900      0.7637000    
 H   -5.250300       1.055000     -0.9952000    
 H   -6.557400      -1.065600     -0.7922000    
 H   -6.492300     -0.9476000      0.9636000    
 H   -7.768400       1.193700      0.8783000    
 H   -7.819300       1.100700     -0.8796000    
 H   -9.096400     -0.9195000       1.032600    
 H   -9.147300      -1.010800     -0.7387000    
 H   -9.946000      0.3290000      0.1039000    


%chk=000039486-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039486

0 1
O 5.013388 1.236143 1.455505
N 6.169987 -0.378028 0.237818
C 7.394607 0.303105 -0.213196
C 6.625183 -0.654175 -1.145545
C -0.115333 0.339173 0.190955
C 1.153926 -0.538644 0.271074
C -1.423390 -0.480879 0.125336
C 2.454518 0.288536 0.364393
C 3.716184 -0.598766 0.435877
C -2.693030 0.396957 0.051491
C 4.988671 0.198822 0.732426
C -4.002325 -0.422208 -0.002250
C -5.272392 0.455738 -0.070241
C -6.582363 -0.362978 -0.115554
C -7.852465 0.515798 -0.182975
C -9.156352 -0.310426 -0.223906
H 8.331562 -0.031228 0.243501
H 7.324209 1.380611 -0.404152
H 6.059564 -0.206335 -1.972758
H 7.023502 -1.655852 -1.339484
H -0.148517 1.012355 1.072722
H -0.050727 0.998523 -0.699943
H 1.194345 -1.205120 -0.616410
H 1.081135 -1.204876 1.156628
H -1.391594 -1.154119 -0.757113
H -1.486240 -1.140360 1.016390
H 2.527021 0.967642 -0.509185
H 2.431549 0.937698 1.259506
H 3.598454 -1.334464 1.258690
H 3.846604 -1.191484 -0.489922
H -2.720823 1.073887 0.931008
H -2.634239 1.052850 -0.842476
H -3.976637 -1.097940 -0.882917
H -4.059191 -1.079386 0.890919
H -5.295236 1.134433 0.808184
H -5.218438 1.109942 -0.965825
H -6.561557 -1.042134 -0.993758
H -6.637776 -1.016686 0.780297
H -7.870898 1.195917 0.693140
H -7.797309 1.166662 -1.079625
H -9.253104 -0.942538 0.679136
H -9.172424 -0.980669 -1.104264
H -10.048645 0.340302 -0.278099


