%chk=000129576.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129576

0 1
 O  -0.9765000     -0.5849000     -0.1140000    
 O  -0.2545000      -2.765700     -0.2625000    
 O    6.629400       2.272900     -0.4105000    
 N    5.200100      0.6406000      1.9999999E-04
 N    5.457400       1.893500     -0.5009000    
 C   -3.275200      0.1966000     -6.9399998E-02
 C   -4.723500     -0.2666000     -0.3333000    
 C   -3.096200      0.9964000       1.240500    
 C   -5.729300      0.8857000     -0.4232000    
 C   -2.330800      -1.014000     -0.1495000    
 C   -7.165300      0.4143000     -0.6683000    
 C   -3.477000      0.2500000       2.511700    
 C   -8.172800       1.552000     -0.7329000    
 C  -3.5399999E-02  -1.567300     -0.1783000    
 C    1.332100     -0.9908000     -0.1310000    
 C    2.445000      -1.830000     -0.1832000    
 C    1.503700      0.3901000     -3.4899998E-02
 C    3.901300      9.2600003E-02 -4.3000001E-02
 C    3.729600      -1.288300     -0.1392000    
 C    2.788300      0.9318000      9.2000002E-03
 C    6.249600     -0.2091000      0.6124000    
 H   -2.989000      0.8803000     -0.8812000    
 H   -5.040600     -0.9726000      0.4437000    
 H   -4.753400     -0.8211000      -1.280300    
 H   -3.673700       1.926200       1.189200    
 H   -2.048400       1.310700       1.327600    
 H   -5.428400       1.568600      -1.227000    
 H   -5.720500       1.463100      0.5074000    
 H   -2.499000      -1.543200      -1.096000    
 H   -2.522000      -1.715700      0.6703000    
 H   -7.206700     -0.1499000      -1.607500    
 H   -7.462700     -0.2754000      0.1306000    
 H   -3.311300      0.8936000       3.382200    
 H   -4.532800     -3.5100002E-02   2.511000    
 H   -2.871600     -0.6499000       2.649800    
 H   -8.187200       2.114300      0.2061000    
 H   -7.927500       2.244400      -1.544300    
 H   -9.178800       1.159700     -0.9111000    
 H    2.332100      -2.907900     -0.2627000    
 H   0.6655000       1.079600      1.1200000E-02
 H    4.568900      -1.974700     -0.2029000    
 H    2.887800       2.010600      9.6799999E-02
 H    6.638900     -0.9220000     -0.1224000    
 H    5.868500     -0.7512000       1.486200    
 H    7.094000      0.3886000      0.9740000    


%chk=000129576-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129576

0 1
O -1.002797 -0.547654 -0.043119
O -0.269387 -2.760135 -0.123866
O 6.686697 2.393202 0.274853
N 5.343604 0.571583 0.127098
N 5.479510 1.977012 0.230301
C -3.335493 0.189974 -0.050151
C -4.797751 -0.279417 -0.290484
C -3.146524 1.029882 1.246163
C -5.823032 0.871407 -0.403688
C -2.412235 -1.036741 -0.088799
C -7.239317 0.376120 -0.776932
C -3.591382 0.340273 2.556144
C -8.267061 1.522961 -0.887805
C -0.011366 -1.530041 -0.067377
C 1.357421 -0.945089 -0.018967
C 2.465608 -1.826203 -0.042309
C 1.589910 0.455026 0.051781
C 4.006900 0.073953 0.077665
C 3.779624 -1.327557 0.005104
C 2.895556 0.966279 0.100114
C 6.524138 -0.307651 0.078718
H -3.047094 0.838768 -0.904606
H -5.111261 -0.969708 0.519509
H -4.830470 -0.872621 -1.228876
H -3.700221 1.982137 1.133832
H -2.076632 1.302113 1.324299
H -5.477164 1.598865 -1.167838
H -5.878649 1.427336 0.553802
H -2.544312 -1.619403 -1.019440
H -2.572530 -1.719071 0.766237
H -7.191418 -0.173528 -1.739224
H -7.580741 -0.357056 -0.017726
H -3.401554 1.001262 3.421421
H -4.671152 0.103115 2.551229
H -3.039798 -0.600856 2.737085
H -8.358230 2.068702 0.070467
H -7.963092 2.253480 -1.661177
H -9.270009 1.143839 -1.156874
H 2.277066 -2.903299 -0.097091
H 0.734349 1.135553 0.066617
H 4.617646 -2.029370 -0.012689
H 3.069905 2.041968 0.154387
H 6.536030 -0.893189 -0.856719
H 6.538410 -0.992365 0.944491
H 7.410400 0.346940 0.115041


