%chk=000030373.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030373

0 1
 O  -0.1063000     -8.6599998E-02  0.1470000    
 O    1.245500      -1.880300     -0.2835000    
 N   -4.973800     -0.1047000      0.3356000    
 N    2.119300      0.2476000      0.1510000    
 C   -2.493800     -5.9599999E-02  0.2253000    
 C   -2.553200       1.087800     -0.7890000    
 C   -3.765700     -0.9206000      0.1427000    
 C   -3.850300       1.874000     -0.6308000    
 C   -5.068800      0.9522000     -0.6804000    
 C   -1.246400     -0.9125000      2.2000000E-03
 C   -6.169900     -0.9468000      0.3105000    
 C   -7.417000     -0.1387000      0.6267000    
 C    1.119900     -0.6903000     -2.1400001E-02
 C    3.517100      5.5599999E-02  6.6699997E-02
 C    4.382600       1.119500      0.2709000    
 C    3.995700      -1.213600     -0.2229000    
 C    5.758800      0.9097000      0.1835000    
 C    3.880900       2.492100      0.5834000    
 C    5.372000      -1.423200     -0.3103000    
 C    6.253500     -0.3616000     -0.1071000    
 H   -2.429900      0.3864000       1.228100    
 H   -2.493400      0.6906000      -1.810400    
 H   -1.703600       1.768100     -0.6597000    
 H   -3.803100      -1.445200     -0.8219000    
 H   -3.715000      -1.687000      0.9265000    
 H   -3.835700       2.415600      0.3237000    
 H   -3.923300       2.626900      -1.423800    
 H   -5.938100       1.595200     -0.5105000    
 H   -5.167000      0.5230000      -1.686200    
 H   -1.257800      -1.355500      -1.001200    
 H   -1.208800      -1.718600      0.7448000    
 H   -6.291100      -1.455200     -0.6543000    
 H   -6.076600      -1.725700       1.077400    
 H   -7.279000      0.4911000       1.512200    
 H   -7.732800      0.4900000     -0.2112000    
 H   -8.249500     -0.8195000      0.8373000    
 H    1.799500       1.187900      0.3644000    
 H    3.383500      -2.086500     -0.3933000    
 H    6.460100       1.725400      0.3389000    
 H    3.253700       2.867700     -0.2319000    
 H    3.307100       2.489300       1.516000    
 H    4.702800       3.205000      0.7126000    
 H    5.758700      -2.412800     -0.5365000    
 H    7.325100     -0.5251000     -0.1753000    


%chk=000030373-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030373

0 1
O -0.077259 -0.107435 0.211681
O 1.260964 -1.949087 -0.398107
N -5.007740 -0.036688 0.267154
N 2.160337 0.170888 0.197421
C -2.506525 -0.036023 0.151172
C -2.557186 1.032938 -0.966004
C -3.799106 -0.886030 0.126052
C -3.850095 1.868394 -0.850210
C -5.093919 0.957666 -0.832881
C -1.286515 -0.953081 0.024900
C -6.233723 -0.867490 0.401498
C -7.473864 -0.068212 0.842599
C 1.153009 -0.751662 -0.034737
C 3.566475 -0.013400 0.072255
C 4.404141 1.109536 0.363127
C 4.132000 -1.253174 -0.323667
C 5.803381 0.947370 0.244527
C 3.812437 2.443658 0.788442
C 5.532778 -1.379126 -0.431605
C 6.377142 -0.282935 -0.149200
H -2.464581 0.476981 1.132317
H -2.532785 0.523119 -1.953158
H -1.662944 1.679531 -0.912610
H -3.825053 -1.481510 -0.828284
H -3.788883 -1.610306 0.963544
H -3.829409 2.458830 0.086080
H -3.927334 2.580664 -1.694103
H -6.001328 1.568978 -0.687959
H -5.190274 0.444790 -1.828706
H -1.230163 -1.437974 -0.968099
H -1.280358 -1.743806 0.799281
H -6.461448 -1.415439 -0.551225
H -6.020054 -1.638811 1.166666
H -7.249168 0.509689 1.756408
H -7.820962 0.634377 0.064341
H -8.309869 -0.758030 1.060165
H 1.829317 1.091138 0.492128
H 3.472904 -2.096302 -0.540389
H 6.452023 1.803575 0.465805
H 3.142398 2.870429 0.014722
H 3.231404 2.363336 1.729558
H 4.610494 3.183082 0.965798
H 5.960612 -2.340155 -0.737856
H 7.464627 -0.381195 -0.233040


