%chk=000030959.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030959

0 1
 O    6.960400      4.5000002E-02  0.5588000    
 O  -0.2916000     -1.3300000E-02   1.372500    
 N    2.130200     -4.2300001E-02  0.2106000    
 N   -1.412300     -1.4000000E-02 -0.6904000    
 C    3.374300     -4.9500000E-02 -0.5493000    
 C    4.571700     -1.6100001E-02  0.3950000    
 C   -2.775900      2.2000000E-03 -0.3116000    
 C   0.9775000     -3.9799999E-02 -0.6793000    
 C   -3.445200      -1.197900     -0.1246000    
 C   -3.419300       1.217900     -0.1339000    
 C    5.887300     -6.9999998E-04 -0.3715000    
 C  -0.2977000     -2.2900000E-02  0.1457000    
 C   -4.789100      -1.182000      0.2487000    
 C   -4.763100       1.233800      0.2397000    
 C   -2.767200      -2.516500     -0.3120000    
 C   -2.713000       2.520000     -0.3315000    
 C   -5.448100      3.3900000E-02  0.4310000    
 C    8.221000      4.2300001E-02 -9.7800002E-02
 H    3.429400     -0.9465000      -1.178100    
 H    3.414100      0.8261000      -1.208700    
 H    4.555900     -0.8836000       1.067600    
 H    4.522600      0.8674000       1.044700    
 H   0.9695000     -0.9348000      -1.312500    
 H   0.9828000      0.8521000      -1.316800    
 H    2.096800     -0.8643000      0.8135000    
 H    5.932900      0.8786000      -1.024600    
 H    5.973500     -0.9035000     -0.9876000    
 H   -1.257000     -6.3500002E-02  -1.695000    
 H   -5.338000      -2.107200      0.4028000    
 H   -5.291800       2.171900      0.3868000    
 H   -2.327700      -2.585300      -1.312700    
 H   -1.981500      -2.651400      0.4385000    
 H   -3.467000      -3.353100     -0.2098000    
 H   -2.269400       2.570200      -1.331600    
 H   -3.395300       3.372100     -0.2393000    
 H   -1.926600       2.645200      0.4200000    
 H   -6.494400      4.6300001E-02  0.7222000    
 H    9.005300      8.0899999E-02  0.6629000    
 H    8.346900     -0.8740000     -0.6828000    
 H    8.318600      0.9195000     -0.7448000    


%chk=000030959-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000030959

0 1
O 6.908056 0.899152 0.327064
O -0.241809 0.165194 1.152245
N 2.109389 0.204217 -0.322720
N -1.477639 -0.289261 -0.788753
C 3.437445 -0.351138 -0.628641
C 4.544977 0.530970 -0.019642
C -2.814940 -0.102749 -0.280498
C 0.974437 -0.555181 -0.849446
C -3.737039 -1.180504 -0.434498
C -3.203845 1.137065 0.304060
C 5.947288 -0.021880 -0.289162
C -0.297024 -0.180839 -0.064264
C -5.062994 -1.008010 0.025305
C -4.539184 1.259598 0.765793
C -3.303022 -2.492286 -1.066093
C -2.250538 2.308173 0.414867
C -5.462913 0.202541 0.632523
C 8.289444 0.467806 0.133276
H 3.553518 -1.406771 -0.263377
H 3.559293 -0.387255 -1.731129
H 4.403186 0.612423 1.076069
H 4.467202 1.552285 -0.433157
H 1.105197 -1.666379 -0.742797
H 0.837868 -0.354337 -1.932761
H 1.966857 0.410645 0.677126
H 6.139014 -0.095111 -1.385137
H 6.063789 -1.041204 0.147468
H -1.395137 -0.655269 -1.741211
H -5.778296 -1.831582 -0.082914
H -4.853289 2.205569 1.221881
H -3.064747 -2.382388 -2.143875
H -2.401110 -2.899697 -0.572400
H -4.104232 -3.245984 -0.988693
H -1.666713 2.443892 -0.514431
H -2.799119 3.242609 0.621787
H -1.516908 2.136784 1.223202
H -6.490624 0.322768 0.992540
H 8.922559 1.219981 0.629867
H 8.475465 -0.528509 0.590401
H 8.555635 0.417861 -0.945072


