%chk=000026745.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026745

0 1
 O  -0.1288000      -1.499900      0.1355000    
 O    5.152800      -2.228000     -0.3519000    
 O  -0.1268000       4.072800      0.2059000    
 N    1.271800       2.470900       1.150800    
 C   -1.115500     -0.4519000      0.1858000    
 C  -0.4341000      0.7121000      0.9826000    
 C   0.8385000       1.339000      0.3534000    
 C   -1.445100     -8.3700001E-02  -1.273800    
 C   -2.386400     -0.9623000      0.8772000    
 C    1.995100      0.3825000      0.1639000    
 C   -1.318800      -1.056100      -2.231900    
 C   -3.194400     -5.2800000E-02   1.516200    
 C   -1.849000       1.198200      -1.543500    
 C   -2.663700      -2.307100      0.8281000    
 C    2.524100      0.2031000      -1.102600    
 C    2.500100     -0.2924000       1.261900    
 C   0.7465000       3.739700       1.002700    
 C   -1.617000     -0.7230000      -3.553100    
 C   -4.350000     -0.5167000       2.144900    
 C   -2.147500       1.531300      -2.864700    
 C   -3.819500      -2.771000       1.456500    
 C    3.590900     -0.6787000      -1.276700    
 C    3.567000      -1.173900       1.087900    
 C   -2.031400      0.5708000      -3.869600    
 C   -4.662600      -1.875800       2.115100    
 C    4.112300      -1.367200     -0.1814000    
 C    1.354100       4.719400       1.970400    
 C    5.637300      -2.899200      0.8101000    
 H  -0.1850000      0.3414000       1.987800    
 H   -1.126200       1.541800       1.157400    
 H   0.5729000       1.754500     -0.6242000    
 H    1.957400       2.312800       1.884500    
 H   4.8000002E-03  -1.833600       1.039500    
 H   -1.012300      -2.073400      -2.013200    
 H   -3.013500       1.013800       1.537500    
 H   -1.974800       1.960800     -0.7847000    
 H   -2.031300      -3.022600      0.3132000    
 H    2.126600      0.7320000      -1.963900    
 H    2.091500     -0.1500000       2.257800    
 H   -1.530100      -1.471600      -4.335200    
 H   -5.011200      0.1809000       2.650600    
 H   -2.476000       2.536900      -3.110500    
 H   -4.064900      -3.828700       1.430700    
 H    4.011000     -0.8255000      -2.267900    
 H    3.924000      -1.675100       1.981100    
 H   -2.265700      0.8298000      -4.898000    
 H   -5.563700      -2.236500       2.602200    
 H    2.445400       4.647800       1.948300    
 H   0.9947000       4.505000       2.980700    
 H    1.065100       5.737200       1.694200    
 H    6.463600      -3.542800      0.4908000    
 H    6.045900      -2.193600       1.541400    
 H    4.873300      -3.552300       1.245500    


%chk=000026745-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026745

0 1
O -0.299636 -1.706617 -0.059911
O 5.459429 -2.234263 -0.308509
O -0.436379 3.736916 0.461873
N 1.276996 2.358315 1.204346
C -1.149167 -0.498111 0.067213
C -0.422533 0.562120 0.953413
C 0.867895 1.202367 0.357579
C -1.527868 0.017377 -1.341353
C -2.409968 -0.959994 0.833290
C 2.058557 0.255502 0.212507
C -1.708714 -0.932825 -2.379777
C -3.547414 -0.117160 0.908935
C -1.756223 1.390197 -1.621587
C -2.428289 -2.201986 1.512981
C 2.722464 0.119386 -1.037162
C 2.563661 -0.473780 1.318995
C 0.596282 3.560299 1.185660
C -2.106702 -0.524561 -3.670627
C -4.680832 -0.505875 1.655197
C -2.154102 1.796739 -2.916546
C -3.566510 -2.593597 2.255043
C 3.844607 -0.716760 -1.180904
C 3.694224 -1.310946 1.197002
C -2.332636 0.845089 -3.945315
C -4.695815 -1.747331 2.333071
C 4.337837 -1.433764 -0.061378
C 1.154207 4.659652 2.084089
C 6.004634 -3.010142 0.809729
H -0.189344 0.070988 1.916356
H -1.125670 1.384337 1.171508
H 0.615080 1.613025 -0.637052
H 2.124423 2.260054 1.766385
H 0.589126 -1.426765 -0.400844
H -1.534461 -1.990486 -2.157410
H -3.559070 0.836538 0.369132
H -1.609313 2.157865 -0.851705
H -1.552614 -2.851666 1.439572
H 2.351334 0.675862 -1.905765
H 2.059326 -0.410293 2.290617
H -2.244159 -1.272651 -4.460110
H -5.553365 0.155836 1.701183
H -2.319887 2.861545 -3.116209
H -3.570659 -3.560999 2.770980
H 4.353918 -0.829578 -2.142454
H 4.051528 -1.864439 2.070366
H -2.642553 1.164749 -4.946915
H -5.577575 -2.051847 2.908567
H 2.080150 4.370794 2.610967
H 0.391279 4.938420 2.831631
H 1.354898 5.555742 1.472395
H 6.861755 -3.554649 0.388012
H 6.349081 -2.348762 1.628350
H 5.260166 -3.730766 1.199887


