%chk=000055871.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055871

0 1
 O    2.125600       1.810700      -1.593700    
 O    3.708700       1.703600       1.642200    
 N  -0.6621000       1.035800     -5.8499999E-02
 C    1.522600      3.6400001E-02 -0.1059000    
 C    2.182800       1.402400     -0.2244000    
 C   0.1199000     -6.6200003E-02 -5.1399998E-02
 C    3.650300       1.443300      0.2405000    
 C    2.334600      -1.119300     -0.1181000    
 C  -0.4498000      -1.350400      6.5000001E-03
 C   -1.843500      -1.455900      6.5399997E-02
 C    4.401000      0.1688000     -6.0999999E-03
 C    3.794100      -1.009600     -0.1900000    
 C    1.743900      -2.381300     -6.8300001E-02
 C   0.3599000      -2.495200     -1.5000000E-03
 C   -2.646400     -0.3125000      6.2100001E-02
 C   -2.003600      0.9323000     -3.1000001E-03
 C   -2.489500      -2.812400      0.1306000    
 C   -4.049200     -0.3888000      0.1201000    
 C   -2.793800       2.078600     -8.8000000E-03
 C   -4.817400      0.7716000      0.1135000    
 C   -4.188000       2.008000      4.8700001E-02
 H    1.617500       2.136400      0.3631000    
 H    4.173100       2.263800     -0.2641000    
 H    5.486400      0.2144000     -2.0800000E-02
 H    4.378500      -1.908600     -0.3540000    
 H    2.349400      -3.284300     -8.2999997E-02
 H  -3.3199999E-02  -3.506200      1.0300000E-02
 H   -2.650900      -3.204100     -0.8787000    
 H   -1.901800      -3.532900      0.7066000    
 H   -3.438900      -2.821000      0.6708000    
 H    1.216400       1.682500      -1.913600    
 H   -4.598900      -1.322900      0.1436000    
 H   -2.323500       3.059100     -5.9099998E-02
 H    3.169900       1.033900       2.097600    
 H   -5.900800      0.7113000      0.1520000    
 H   -4.777700       2.919900      4.1200001E-02


%chk=000055871-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055871

0 1
O 1.515810 2.360234 -0.552028
O 4.387666 2.507966 0.454856
N -0.624172 0.955319 -0.007611
C 1.557701 -0.068390 0.051621
C 2.201807 1.325033 0.201774
C 0.120259 -0.200548 0.007552
C 3.694057 1.382766 -0.205549
C 2.354524 -1.225684 0.086585
C -0.509126 -1.524128 -0.018806
C -1.934920 -1.609202 -0.057557
C 4.448052 0.091091 0.038422
C 3.819245 -1.111536 0.161088
C 1.736325 -2.526640 0.062910
C 0.358870 -2.674365 0.010183
C -2.695084 -0.395693 -0.060495
C -1.988423 0.877528 -0.034779
C -2.668361 -2.936589 -0.092261
C -4.134782 -0.371310 -0.090156
C -2.737215 2.105418 -0.042129
C -4.833365 0.833369 -0.094954
C -4.127957 2.084797 -0.071363
H 2.146782 1.552834 1.301456
H 3.738087 1.655014 -1.276884
H 5.541413 0.175280 0.053170
H 4.398530 -2.033595 0.294897
H 2.381527 -3.412857 0.086864
H -0.066059 -3.681637 -0.003776
H -3.316736 -3.003440 -0.985520
H -1.990729 -3.800704 -0.112942
H -3.322237 -3.048802 0.792853
H 0.525395 2.167059 -0.396969
H -4.689819 -1.314344 -0.108194
H -2.174655 3.044020 -0.022556
H 4.274144 2.406572 1.435715
H -5.928520 0.832851 -0.117247
H -4.692435 3.023514 -0.076470


