%chk=000055474.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055474

0 1
 I   0.7863000       3.401100      4.0199999E-02
 I    6.026500      0.5064000     -0.1462000    
 O  -0.9022000      0.1075000      -1.921300    
 O    1.969500      -3.119800     -0.2490000    
 O   0.2111000      -2.345600      0.9656000    
 N  -0.2210000      0.2829000      0.3171000    
 C    1.189900      0.3529000      0.2119000    
 C    1.913700     -0.8304000      0.2380000    
 C    1.825300       1.579300      8.5299999E-02
 C   -2.560300      0.1463000     -0.2903000    
 C    3.303900     -0.7859000      0.1351000    
 C   -1.168300      0.1681000     -0.7100000    
 C    3.215700       1.623800     -1.7700000E-02
 C    3.955000      0.4411000      7.1999999E-03
 C   -3.515100     -0.5012000      -1.074400    
 C   -2.941000      0.7726000      0.8966000    
 C    1.269200      -2.131900      0.3697000    
 C   -4.850600     -0.5224000     -0.6718000    
 C   -4.276300      0.7514000       1.299100    
 C   -5.231100      0.1038000      0.5149000    
 H  -0.5372000      0.1109000       1.268800    
 H    3.892800      -1.699900      0.1682000    
 H    3.727100       2.579000     -0.1175000    
 H   -3.239100     -0.9999000      -1.999900    
 H   -2.235500       1.312600       1.521700    
 H   -5.593900      -1.027200      -1.281800    
 H   -4.574600       1.244600       2.219700    
 H   -6.271100      8.8600002E-02  0.8277000    
 H    1.530000      -3.992000     -0.1566000    


%chk=000055474-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055474

0 1
I 0.745936 3.339202 -0.348302
I 6.089565 0.488912 -0.705751
O -0.879904 0.950942 -1.839085
O 2.339022 -3.196110 0.929629
O 0.259547 -2.285231 1.356251
N -0.237741 0.121936 0.266318
C 1.155217 0.249081 0.099237
C 2.010297 -0.880920 0.370731
C 1.786110 1.467046 -0.298449
C -2.628613 0.325718 -0.271155
C 3.410378 -0.810100 0.150737
C -1.202422 0.511050 -0.699427
C 3.175558 1.522510 -0.540792
C 3.977792 0.377583 -0.332549
C -3.621853 0.315622 -1.285201
C -3.016958 0.196598 1.088715
C 1.436929 -2.134519 0.914169
C -4.981146 0.161639 -0.947330
C -4.379512 0.044844 1.424678
C -5.363391 0.022488 0.408822
H -0.511443 -0.642540 0.907347
H 4.017982 -1.692211 0.361122
H 3.630519 2.463425 -0.857805
H -3.302123 0.437099 -2.325395
H -2.268503 0.247211 1.887272
H -5.742031 0.151370 -1.735152
H -4.674373 -0.047109 2.475562
H -6.420398 -0.094944 0.672401
H 1.894258 -3.993895 1.323703


