%chk=000077529.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077529

0 1
 I   0.7244000      -2.735800     -1.1000000E-02
 O    2.291200      0.5550000      -1.117400    
 N    2.327700      0.5523000       1.175500    
 C   0.2222000      0.2941000     -2.2800000E-02
 C  -0.3860000     -0.9610000     -5.1000002E-03
 C  -0.5607000       1.448600     -1.7800000E-02
 C   -1.777000      -1.061800      1.7500000E-02
 C   -1.951800       1.347800      4.8000002E-03
 C   -2.559900      9.2699997E-02  2.2399999E-02
 C    1.669900      0.4681000     -4.6100002E-02
 H  -0.1008000       2.433600     -3.1500001E-02
 H   -2.274700      -2.028100      3.1700000E-02
 H   -2.561400       2.246600      8.7000001E-03
 H   -3.643000      1.4500000E-02  3.9999999E-02
 H    1.833200      0.4904000       2.059800    
 H    3.333300      0.6799000       1.219100    


%chk=000077529-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077529

0 1
I 0.687524 -2.721411 0.614016
O 2.105323 1.774194 -0.556671
N 2.524869 0.113565 0.992417
C 0.210388 0.414432 0.110118
C -0.397489 -0.858532 0.290513
C -0.655510 1.511675 -0.175479
C -1.801353 -1.021806 0.211065
C -2.052175 1.365186 -0.246857
C -2.630465 0.091280 -0.047228
C 1.684130 0.799569 0.142192
H -0.174356 2.479335 -0.352276
H -2.245947 -2.011927 0.344015
H -2.683289 2.233806 -0.461967
H -3.715584 -0.048072 -0.102168
H 2.223894 -0.675624 1.563338
H 3.506640 0.391231 1.002775


