%chk=000007574.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007574

0 1
 O    3.809300      0.2972000      0.3542000    
 N   -1.659400       1.236500     -1.6799999E-02
 C    4.301500     -0.9119000     -0.2215000    
 C    2.470900      0.5268000      0.2631000    
 C  -0.2746000      0.9990000      7.8000002E-02
 C    5.290600     -0.5739000      -1.326600    
 C    4.937300      -1.762700      0.8674000    
 C    2.001400       1.660600     -0.4001000    
 C    1.568700     -0.3709000      0.8339000    
 C   0.6297000       1.896500     -0.4924000    
 C   0.1970000     -0.1352000      0.7413000    
 C   -2.775300      0.3750000     -6.5499999E-02
 C   -4.001800      0.7925000      0.4514000    
 C   -2.652300     -0.8945000     -0.6302000    
 C   -5.105100     -5.9599999E-02  0.4035000    
 C   -3.755700      -1.746500     -0.6784000    
 C   -4.982200      -1.329000     -0.1615000    
 H    3.489400      -1.493000     -0.6797000    
 H    5.692300      -1.478300      -1.793500    
 H    4.807200      3.3000000E-02  -2.099700    
 H    6.124600      1.9800000E-02 -0.9365000    
 H    5.330500      -2.699600      0.4612000    
 H    4.210800      -2.001900       1.650500    
 H    5.756300      -1.222400       1.355200    
 H    2.699600       2.363000     -0.8471000    
 H    1.916800      -1.251100       1.366600    
 H   0.2764000       2.783100      -1.013000    
 H  -0.4811000     -0.8390000       1.216000    
 H   -1.903400       2.222100     -5.7700001E-02
 H   -4.110100       1.778900      0.8949000    
 H   -1.715500      -1.237900      -1.060300    
 H   -6.060100      0.2654000      0.8060000    
 H   -3.661600      -2.733000      -1.122800    
 H   -5.841700      -1.991900     -0.2000000    


%chk=000007574-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000007574

0 1
O 3.844748 0.299619 -0.592097
N -1.694324 1.192108 0.267374
C 4.516511 -1.011731 -0.379776
C 2.465123 0.413646 -0.342070
C -0.326883 0.887849 0.039566
C 5.821930 -0.920739 -1.176976
C 4.746611 -1.257538 1.122691
C 1.928347 1.715648 -0.503657
C 1.600454 -0.647632 0.025899
C 0.554078 1.945656 -0.326986
C 0.222297 -0.407998 0.221638
C -2.825920 0.358587 0.147156
C -4.039419 0.774885 0.770065
C -2.827035 -0.849920 -0.607392
C -5.213602 0.007122 0.643469
C -4.007959 -1.613861 -0.717276
C -5.208835 -1.200377 -0.094851
H 3.875453 -1.809422 -0.810653
H 6.391274 -1.863664 -1.089497
H 5.612973 -0.730602 -2.243382
H 6.447163 -0.095331 -0.793512
H 5.226942 -2.240605 1.281437
H 3.800055 -1.239978 1.689575
H 5.408648 -0.475326 1.534230
H 2.604202 2.528439 -0.786587
H 1.979494 -1.662497 0.178470
H 0.152242 2.954601 -0.482100
H -0.417892 -1.231201 0.551260
H -1.887251 2.152919 0.554181
H -4.051884 1.701336 1.359014
H -1.923448 -1.168645 -1.134247
H -6.134020 0.349237 1.130499
H -3.989886 -2.536777 -1.308812
H -6.119788 -1.800706 -0.186754


