%chk=000023590.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023590

0 1
 O   -1.884300      0.1673000     -8.8200003E-02
 N    4.446000     -0.2345000     -0.3546000    
 C   0.2190000       1.239000      0.2809000    
 C   6.4599998E-02  -1.171800      0.2535000    
 C  -0.5437000      7.8900002E-02  0.1475000    
 C  -0.4143000       2.587000      0.1699000    
 C  -0.7348000      -2.425200      0.1129000    
 C    2.198600     -0.1023000      0.6262000    
 C    1.590200       1.148600      0.5201000    
 C    1.435900      -1.262400      0.4929000    
 C  -0.4158000       3.109400      -1.272800    
 C  -0.8006000      -2.910600      -1.341300    
 C    3.664600     -0.1984000      0.8828000    
 C   -1.092000       4.466700      -1.383600    
 C   -1.587300      -4.204900      -1.471900    
 C   -2.739700      0.2083000       1.051400    
 C    5.866500     -0.3384000     -6.1999999E-02
 C   -4.150100      0.3617000      0.5873000    
 C   -5.122700     -0.5184000      0.8491000    
 H   0.1279000       3.296100      0.8100000    
 H   -1.435600       2.588300      0.5609000    
 H   -1.748700      -2.308800      0.5056000    
 H  -0.2856000      -3.210700      0.7358000    
 H    2.186700       2.052500      0.6203000    
 H    1.911900      -2.237100      0.5719000    
 H   0.6132000       3.188800      -1.644100    
 H  -0.9347000       2.399500      -1.928500    
 H   -1.266500      -2.143200      -1.971500    
 H   0.2125000      -3.067800      -1.731300    
 H    3.864400      -1.099400       1.477900    
 H    3.979300      0.6497000       1.505500    
 H   -2.136100       4.411700      -1.059300    
 H  -0.5788000       5.211300     -0.7670000    
 H   -1.076300       4.814900      -2.421100    
 H   -1.126600      -5.004600     -0.8834000    
 H   -2.617700      -4.073300      -1.126400    
 H   -1.617900      -4.526500      -2.517600    
 H    4.278500      0.6200000     -0.8858000    
 H   -2.618400     -0.6979000       1.655000    
 H   -2.486600       1.059700       1.692500    
 H    6.430500     -0.3676000     -0.9995000    
 H    6.223200      0.5197000      0.5170000    
 H    6.093500      -1.259100      0.4854000    
 H   -4.391100       1.248300      6.8000001E-03
 H   -6.129900     -0.3481000      0.4848000    
 H   -4.934500      -1.417700       1.425100    


%chk=000023590-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023590

0 1
O -1.873196 0.153286 -0.078341
N 4.533077 -0.881911 0.071528
C 0.211768 1.388260 0.329057
C 0.221722 -1.095626 0.218020
C -0.465102 0.148104 0.184269
C -0.521494 2.711579 0.175354
C -0.508453 -2.403358 -0.042312
C 2.326713 0.137097 0.608730
C 1.612350 1.356039 0.542062
C 1.620060 -1.077463 0.436962
C -0.784596 3.070807 -1.314672
C -0.743149 -2.656018 -1.558827
C 3.826264 0.131837 0.882045
C -1.528903 4.413235 -1.471360
C -1.491605 -3.979579 -1.820983
C -2.712301 0.120265 1.153365
C 5.975778 -0.991285 0.346765
C -4.142628 0.330381 0.735410
C -5.172967 -0.467250 1.108651
H 0.072388 3.521640 0.642523
H -1.497841 2.686811 0.696060
H -1.495901 -2.410104 0.456964
H 0.076390 -3.245032 0.377300
H 2.152132 2.306374 0.650725
H 2.183134 -2.017369 0.464357
H 0.183099 3.109784 -1.852309
H -1.373263 2.253890 -1.772207
H -1.320906 -1.807069 -1.969531
H 0.234686 -2.664364 -2.079323
H 4.012173 -0.120410 1.947773
H 4.227400 1.167357 0.736635
H -2.512308 4.383317 -0.964205
H -0.949841 5.247062 -1.030241
H -1.706570 4.651683 -2.536086
H -0.926958 -4.845078 -1.424385
H -2.485340 -3.973719 -1.334389
H -1.647395 -4.144935 -2.902925
H 4.325964 -0.774544 -0.929669
H -2.581828 -0.847248 1.678619
H -2.374572 0.931117 1.834237
H 6.424651 -1.750376 -0.317913
H 6.545916 -0.037708 0.218503
H 6.128185 -1.328609 1.389503
H -4.319299 1.207162 0.096884
H -6.203190 -0.252340 0.804681
H -5.017544 -1.356989 1.731798


