%chk=000099574.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099574

0 1
 O    2.214200      -2.777300      0.2807000    
 O  -0.4782000      -2.590300     -0.3237000    
 O   -6.092700      0.7862000      0.5322000    
 N   -2.490400      0.1960000      7.9499997E-02
 C  -0.2279000     -0.2526000     -0.7636000    
 C   -1.678700     -0.1258000      -1.094600    
 C    1.944500      0.7775000     -0.5270000    
 C   0.5871000      0.8773000     -0.8320000    
 C   0.3143000      -1.482400     -0.3903000    
 C    1.671900      -1.582300     -8.5199997E-02
 C    2.486900     -0.4522000     -0.1536000    
 C    2.815600       1.985600     -0.6015000    
 C   -3.895600      0.3010000     -0.2797000    
 C   -4.732700      0.6782000      0.9321000    
 C    2.883500       2.745000      0.6982000    
 C    2.217300      -3.088400       1.672500    
 C    2.460800       4.004400      0.8562000    
 H   -1.796200      0.6681000      -1.845700    
 H   -2.043400      -1.032500      -1.593100    
 H   0.1652000       1.837600      -1.119800    
 H   -2.175300       1.079900      0.4795000    
 H    3.544300     -0.5362000      8.5699998E-02
 H    3.834900       1.692100     -0.8846000    
 H    2.471300       2.637700      -1.415300    
 H   -4.263900     -0.6500000     -0.6845000    
 H   -4.045600       1.053600      -1.064300    
 H   -4.417800       1.642200       1.345800    
 H   -4.660100     -8.4799998E-02   1.714400    
 H    3.319700       2.233800       1.553100    
 H   -1.404600      -2.332900     -0.1919000    
 H    1.195300      -3.120600       2.063000    
 H    2.809000      -2.353800       2.228000    
 H    2.672300      -4.074200       1.802300    
 H   -6.604200       1.026900       1.323400    
 H    2.546000       4.496000       1.819100    
 H    2.024400       4.562900      3.5500001E-02


%chk=000099574-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099574

0 1
O 1.942852 -2.665773 0.592757
O -0.879099 -1.894985 0.163918
O -6.198808 -0.299137 0.441585
N -2.500466 0.114371 0.281874
C -0.106562 0.368119 -0.355779
C -1.542726 0.734267 -0.700234
C 2.291002 0.914639 -0.307479
C 0.942640 1.298273 -0.512395
C 0.168960 -0.977836 0.039234
C 1.522238 -1.364656 0.268427
C 2.556068 -0.417337 0.083554
C 3.435423 1.906673 -0.526413
C -3.932769 0.224891 -0.104886
C -4.819804 -0.535684 0.887354
C 3.209240 3.255461 0.132273
C 1.138452 -3.456783 1.545496
C 3.229495 4.451053 -0.509778
H -1.665824 1.835189 -0.762835
H -1.811653 0.314247 -1.690831
H 0.713542 2.329442 -0.809619
H -2.337718 0.508837 1.222248
H 3.582219 -0.757329 0.263313
H 4.368790 1.460835 -0.127067
H 3.602108 2.062260 -1.611470
H -4.055620 -0.215688 -1.110359
H -4.275253 1.280629 -0.157957
H -4.662683 -0.148180 1.919000
H -4.561022 -1.614886 0.873443
H 3.016569 3.227049 1.215976
H -1.750121 -1.301787 0.243621
H 0.121472 -3.626176 1.159519
H 1.083589 -2.941126 2.524635
H 1.689204 -4.404103 1.654083
H -6.825212 -0.832335 0.991299
H 3.072054 5.394833 0.024615
H 3.410624 4.518432 -1.590320


