%chk=000085553.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085553

0 1
 O    1.276600     -3.9400000E-02 -0.3649000    
 O   -1.175500       1.555100     -0.9397000    
 O   0.5535000       1.081800       1.540100    
 N   -1.747000     -0.5195000      6.6999998E-03
 C  -0.9353000      0.5839000     -0.2328000    
 C   -1.388100      -1.643300      0.8665000    
 C   -3.059600     -0.5905000     -0.6175000    
 C    2.604700     -0.1465000      0.1546000    
 C   0.3992000      0.5891000      0.4402000    
 C    3.471600     -0.8708000     -0.8532000    
 H   -1.399900      -2.557800      0.2664000    
 H   -2.132400      -1.722900       1.664400    
 H  -0.4016000      -1.532700       1.318500    
 H   -3.253000      0.2821000      -1.247000    
 H   -3.820900     -0.6396000      0.1664000    
 H   -3.108900      -1.492600      -1.234200    
 H    3.007900      0.8559000      0.3375000    
 H    2.584600     -0.7067000       1.096200    
 H    4.497100     -0.9708000     -0.4868000    
 H    3.070800      -1.868700      -1.059500    
 H    3.487500     -0.3314000      -1.806100    


%chk=000085553-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085553

0 1
O 1.365974 -0.175011 -0.349563
O -1.172124 1.416813 -1.067093
O 0.616045 0.883861 1.594508
N -1.851756 -0.554674 0.010394
C -0.949108 0.449224 -0.277706
C -1.567761 -1.677654 0.914575
C -3.181608 -0.525489 -0.620690
C 2.778215 -0.113641 0.159329
C 0.396924 0.396037 0.461949
C 3.650289 -0.784678 -0.895286
H -1.638394 -2.639222 0.371060
H -2.289984 -1.692169 1.752845
H -0.555713 -1.591332 1.339302
H -3.235437 0.358146 -1.275299
H -3.973558 -0.459728 0.149209
H -3.344095 -1.438764 -1.223658
H 3.035448 0.949407 0.313802
H 2.816325 -0.626354 1.137721
H 4.708085 -0.757126 -0.575881
H 3.358222 -1.838924 -1.039722
H 3.565309 -0.264021 -1.863995


