%chk=000130332.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130332

0 1
 O   -2.686300      2.8500000E-02  0.3462000    
 O   -3.195700       2.192800      -1.364800    
 O   -1.705900      -3.175900      0.9866000    
 O    2.803100      -2.643500      0.2559000    
 N  -0.9994000      -1.420000     -0.3773000    
 N   0.5401000      -2.898300      0.6143000    
 N   -5.649600       2.064500       1.192900    
 C   -4.005000      0.5248000      0.1611000    
 C    1.339800      -1.095500     -0.7915000    
 C   -2.345900     -0.9282000     -0.6458000    
 C    2.482300     -0.3653000      -1.420900    
 C   5.7500001E-02 -0.7482000     -0.9567000    
 C   -4.290900       1.544700       1.265800    
 C   -4.114100       1.110900      -1.244900    
 C    3.005700      0.7470000     -0.5531000    
 C  -0.8013000      -2.538100      0.4437000    
 C    1.648200      -2.272000      6.4300001E-02
 C    4.019500      0.4844000      0.3583000    
 C    2.468000       2.021000     -0.6750000    
 C    4.504800       1.515300       1.162800    
 C    2.953300       3.052000      0.1295000    
 C    3.971700       2.799200       1.048500    
 H   -4.709500     -0.3116000      0.2603000    
 H   -3.047700      -1.769300     -0.6031000    
 H   -2.329800     -0.5281000      -1.661500    
 H    2.170900      5.1500000E-02  -2.389100    
 H    3.295200      -1.056000      -1.680100    
 H  -0.2028000      0.1086000      -1.570700    
 H   -3.575300       2.373700       1.221000    
 H   -4.135900       1.070900       2.242700    
 H   -5.116300       1.524900      -1.401100    
 H   -3.964200      0.4105000      -2.068300    
 H   0.7202000      -3.705900       1.204300    
 H    4.449700     -0.5080000      0.4535000    
 H    1.674400       2.230200      -1.386700    
 H   -5.819000       2.682300       1.985400    
 H   -6.315600       1.298000       1.279900    
 H    5.298900       1.318800       1.877200    
 H    2.538200       4.051700      4.0600002E-02
 H   -2.302200       1.837600      -1.220900    
 H    4.349800       3.602000       1.674700    


%chk=000130332-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130332

0 1
O -2.697239 0.459309 -1.472601
O -5.363334 1.514784 -0.831813
O -2.328648 -3.106250 -0.088361
O 2.289383 -2.762488 0.537466
N -1.163777 -1.413282 -1.252558
N -0.008747 -2.898037 0.168521
N -3.269705 2.356959 1.696841
C -3.185175 0.608780 -0.058796
C 1.244330 -1.130496 -0.943065
C -2.409599 -0.903897 -1.876483
C 2.540877 -0.374189 -1.187654
C 0.045904 -0.756798 -1.501544
C -2.697125 2.004459 0.388142
C -4.711959 0.457681 -0.047408
C 2.792631 0.716879 -0.141016
C -1.247283 -2.518173 -0.366206
C 1.264831 -2.291382 -0.038187
C 3.288175 0.381229 1.146106
C 2.516250 2.076223 -0.434817
C 3.495699 1.385853 2.117622
C 2.724588 3.082800 0.536446
C 3.213631 2.739542 1.817846
H -2.734339 -0.171063 0.586029
H -3.207342 -1.617673 -1.604826
H -2.276926 -0.855170 -2.969565
H 2.516814 0.077095 -2.196292
H 3.369092 -1.105377 -1.165063
H -0.036017 0.110072 -2.163690
H -2.949157 2.730283 -0.413664
H -1.595393 1.973171 0.464159
H -5.082101 0.570335 0.983453
H -5.000765 -0.548734 -0.418778
H -0.030099 -3.703637 0.802531
H 3.503653 -0.668212 1.377788
H 2.145412 2.351816 -1.430648
H -4.189401 2.801303 1.648259
H -2.632640 2.821793 2.344617
H 3.881003 1.113184 3.106727
H 2.513771 4.130251 0.291684
H -4.929711 1.525046 -1.724461
H 3.379338 3.517912 2.571255


