%chk=000129374.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129374

0 1
 O   -3.365100     -0.7976000     -0.4944000    
 O   -2.878700       2.011200      -1.070300    
 O  -0.9271000       3.136800      0.7234000    
 O   -2.280500      -3.033000     -0.2470000    
 N   0.2208000     -0.3710000      0.4168000    
 C   -1.099600      -1.035300      0.3202000    
 C   -2.065600     -0.2046000     -0.5580000    
 C   -2.178300       1.246100     -8.7800004E-02
 C  -0.7977000       1.864900      9.0000004E-02
 C   8.9299999E-02  0.9865000      0.9657000    
 C    1.175300      -1.126400       1.234000    
 C  -0.9925000      -2.456400     -0.2640000    
 C    2.550400     -0.4620000       1.193600    
 C    3.082800     -0.3792000     -0.2386000    
 C    4.474000      0.2528000     -0.2793000    
 C    4.992400      0.3673000      -1.704000    
 H   -1.542300      -1.122600       1.323800    
 H   -1.755500     -0.2325000      -1.610200    
 H   -2.759700       1.322400      0.8391000    
 H  -0.3319000       2.037300     -0.8886000    
 H    1.044300       1.516300       1.013800    
 H  -0.2981000      0.9647000       1.994100    
 H   0.8331000      -1.213400       2.272900    
 H    1.318100      -2.141400      0.8533000    
 H  -0.3527000      -3.120200      0.3207000    
 H  -0.6253000      -2.442100      -1.295500    
 H    2.585000      0.5083000       1.696900    
 H    3.235400      -1.095500       1.774100    
 H   -3.656300     -0.7848000      0.4333000    
 H    3.124500      -1.383600     -0.6778000    
 H    2.412400      0.2196000     -0.8657000    
 H   -3.745700       1.590300      -1.200800    
 H  -3.7700001E-02   3.524200      0.7912000    
 H    4.442700       1.251700      0.1714000    
 H    5.173800     -0.3487000      0.3122000    
 H   -2.571600      -3.087300      0.6793000    
 H    5.989000      0.8195000      -1.709500    
 H    5.063700     -0.6180000      -2.175800    
 H    4.332200      0.9932000      -2.313000    


%chk=000129374-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129374

0 1
O -3.457120 -0.610314 -0.456710
O -3.039370 2.158511 -0.784219
O -0.899526 3.310659 0.782475
O -2.276454 -3.030728 -0.412469
N 0.203881 -0.271136 0.541915
C -1.120341 -0.961552 0.428135
C -2.083126 -0.093561 -0.439731
C -2.207679 1.332231 0.097250
C -0.829683 1.979603 0.174027
C 0.074704 1.119602 1.063334
C 1.214277 -1.030255 1.338653
C -0.964493 -2.349296 -0.252799
C 2.654483 -0.481309 1.216184
C 3.165311 -0.402909 -0.238652
C 4.626398 0.090588 -0.336956
C 5.136377 0.167008 -1.792290
H -1.601238 -1.105227 1.434670
H -1.670216 -0.056814 -1.472306
H -2.658217 1.292521 1.113305
H -0.409983 2.042422 -0.852153
H 1.071895 1.585590 1.090849
H -0.332525 1.137658 2.105377
H 0.922730 -1.062527 2.420717
H 1.237164 -2.073134 0.978536
H -0.284198 -3.020449 0.299652
H -0.581255 -2.219731 -1.277976
H 2.741477 0.512735 1.696837
H 3.311801 -1.156267 1.802516
H -3.394588 -1.584377 -0.682195
H 3.083388 -1.405928 -0.708839
H 2.501755 0.262851 -0.823800
H -3.869984 1.644979 -0.961736
H -1.625903 3.801249 0.316943
H 4.706099 1.090882 0.136138
H 5.282940 -0.583621 0.251126
H -2.544749 -3.428531 0.453307
H 6.182780 0.520736 -1.838121
H 5.092759 -0.825602 -2.279529
H 4.517733 0.860942 -2.391963


