%chk=000009929.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000009929

0 1
 O  -0.9601000      0.7133000      1.7999999E-02
 N    3.616800      -2.950600     -3.5999998E-02
 C    1.745200      -1.625200      0.8770000    
 C   0.4700000     -0.9003000      0.5614000    
 C    2.389200      -2.230700     -0.3728000    
 C   0.3476000      0.4147000      0.2351000    
 C  -0.8116000      -1.464900      0.5525000    
 C   -1.658800     -0.4359000      0.2130000    
 C    1.259100       1.513500      7.5999998E-02
 C   -3.078900     -0.3317000      2.9600000E-02
 C    4.602600      -2.037700      0.5415000    
 C    4.163800      -3.610600      -1.220900    
 C    1.836400       1.774100      -1.170300    
 C    1.574500       2.329900       1.166300    
 C   -3.895900      -1.453000      0.2051000    
 C   -3.655700      0.8916000     -0.3255000    
 C    2.721000       2.841300      -1.325000    
 C    2.459100       3.397100       1.011500    
 C    3.032300       3.652900     -0.2341000    
 C   -5.275700      -1.351800      2.7400000E-02
 C   -5.035500      0.9928000     -0.5032000    
 C   -5.845500     -0.1289000     -0.3267000    
 H    2.410500     -0.9104000       1.373400    
 H    1.535900      -2.416400       1.609100    
 H    2.581800      -1.447600      -1.118600    
 H    1.672300      -2.926900     -0.8282000    
 H   -1.083400      -2.489200      0.7653000    
 H    4.326400      -1.723500       1.552400    
 H    4.767200      -1.149700     -7.9999998E-02
 H    5.568600      -2.544300      0.6581000    
 H    5.054600      -4.193500     -0.9613000    
 H    4.436200      -2.894600      -2.004800    
 H    3.438900      -4.319100      -1.637300    
 H    1.604600       1.150900      -2.031100    
 H    1.136400       2.144400       2.144400    
 H   -3.483000      -2.419900      0.4810000    
 H   -3.059000       1.788600     -0.4723000    
 H    3.167700       3.040300      -2.294700    
 H    2.701700       4.029000       1.860900    
 H    3.721200       4.483900     -0.3546000    
 H   -5.906800      -2.225000      0.1648000    
 H   -5.479700       1.944800     -0.7790000    
 H   -6.919900     -5.0099999E-02 -0.4650000    


%chk=000009929-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000009929

0 1
O -0.966909 0.824873 -0.188129
N 3.609834 -3.055293 0.357316
C 1.773145 -1.458932 1.040415
C 0.531944 -0.737428 0.571661
C 2.487392 -2.213200 -0.114352
C 0.397100 0.588141 0.130949
C -0.781811 -1.329212 0.512142
C -1.679328 -0.369954 0.049735
C 1.288654 1.738054 -0.021780
C -3.113918 -0.362898 -0.219768
C 4.751074 -2.273588 0.875450
C 4.037416 -4.029326 -0.668944
C 0.741916 3.052344 -0.118747
C 2.705434 1.590601 -0.080555
C -3.899805 -1.524021 0.031618
C -3.755210 0.798138 -0.738582
C 1.581751 4.174539 -0.256617
C 3.541031 2.719019 -0.209563
C 2.987763 4.017602 -0.297008
C -5.284320 -1.521839 -0.228010
C -5.141013 0.794391 -0.995914
C -5.914481 -0.363207 -0.743086
H 2.466526 -0.747926 1.524327
H 1.503462 -2.211957 1.803423
H 2.814226 -1.476474 -0.895646
H 1.747669 -2.876636 -0.600633
H -1.021316 -2.352992 0.795805
H 4.440802 -1.657884 1.736503
H 5.203939 -1.594891 0.105671
H 5.539379 -2.962920 1.226413
H 4.808403 -4.698844 -0.246895
H 4.462389 -3.551330 -1.588399
H 3.176578 -4.650478 -0.974186
H -0.344197 3.177586 -0.078874
H 3.155431 0.594492 -0.054948
H -3.425202 -2.426685 0.432431
H -3.156319 1.692011 -0.937960
H 1.140525 5.175058 -0.328285
H 4.627537 2.582980 -0.254844
H 3.640212 4.891390 -0.401202
H -5.874528 -2.423199 -0.028426
H -5.619763 1.695235 -1.395923
H -6.991309 -0.363740 -0.944185


