%chk=000102343.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102343

0 1
 O    7.525200     -0.3997000      0.3961000    
 O   -7.198700      -1.143500     -4.9899999E-02
 O   -7.165100       1.133400      0.3398000    
 N    1.297400      0.7267000     -0.5210000    
 C    3.411000     -1.4800000E-02  0.4193000    
 C    6.170300     -0.2731000      0.4036000    
 C   -2.867600      0.8882000     -0.1084000    
 C  -9.3400002E-02  0.7804000     -0.3829000    
 C    4.136700      0.5162000     -0.6349000    
 C    4.037400     -0.6725000       1.465900    
 C    5.525500      0.3862000     -0.6429000    
 C    5.426200     -0.8026000       1.457900    
 C   -2.074200       1.906200      0.4208000    
 C   -2.273700     -0.1835000     -0.7751000    
 C  -0.6871000       1.852300      0.2835000    
 C  -0.8867000     -0.2374000     -0.9124000    
 C    1.944500      0.1217000      0.4275000    
 C   -4.313900      0.9447000      3.4499999E-02
 C    8.164100     -0.4686000     -0.8780000    
 C    9.428600      -1.291300     -0.7516000    
 C   -5.150600     -0.1110000     -7.6399997E-02
 C   -6.608900      7.3100001E-02  0.1016000    
 C   -8.623300      -1.157800      8.8799998E-02
 C   -9.123500      -2.573300     -0.1059000    
 H    3.659600       1.039200      -1.458600    
 H    3.468800      -1.089200       2.292500    
 H    6.069300      0.8366000      -1.468100    
 H    5.923000      -1.317400       2.275700    
 H   -2.518800       2.748900      0.9447000    
 H   -2.851600     -0.9879000      -1.220700    
 H  -7.7500001E-02   2.650500      0.6990000    
 H  -0.4331000      -1.073900      -1.437900    
 H    1.411600     -0.3211000       1.290500    
 H   -4.723300       1.927200      0.2598000    
 H    8.413200      0.5449000      -1.211000    
 H    7.528300     -0.9562000      -1.627600    
 H    9.951000      -1.356400      -1.710200    
 H    10.10360     -0.8494000     -1.1200000E-02
 H    9.196900      -2.304300     -0.4058000    
 H   -4.803200      -1.118900     -0.2734000    
 H   -9.070100     -0.5002000     -0.6652000    
 H   -8.896300     -0.8027000       1.088800    
 H   -8.671300      -3.246400      0.6300000    
 H   -8.842100      -2.948800      -1.095200    
 H   -10.21150      -2.620800     -6.3000000E-03


%chk=000102343-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102343

0 1
O 7.813505 -0.218762 0.104522
O -7.654593 -0.881321 -0.375967
O -7.231646 0.998128 0.954043
N 1.286203 -0.184392 -0.176916
C 3.607537 -0.047152 0.560746
C 6.420052 -0.177844 0.182184
C -2.940709 0.285465 0.301550
C -0.098772 -0.005087 0.028003
C 4.154645 -0.326177 -0.722404
C 4.501280 0.163659 1.651339
C 5.544512 -0.392903 -0.919576
C 5.890561 0.100633 1.469942
C -2.041129 1.187536 0.941985
C -2.380328 -0.755696 -0.501253
C -0.648578 1.051059 0.815142
C -0.993512 -0.888932 -0.646589
C 2.160935 0.028627 0.780468
C -4.380043 0.477178 0.482527
C 8.435266 -0.497797 -1.209809
C 9.945512 -0.477390 -0.994536
C -5.394125 -0.286603 -0.034816
C -6.800866 0.043332 0.253263
C -9.113491 -0.661431 -0.162172
C -9.842198 -1.771817 -0.912854
H 3.460984 -0.488974 -1.553728
H 4.095660 0.378017 2.647975
H 5.937908 -0.609552 -1.916914
H 6.586636 0.260806 2.298447
H -2.452272 2.008230 1.542766
H -3.040850 -1.457524 -1.021568
H 0.019648 1.777180 1.292150
H -0.562635 -1.676891 -1.272270
H 1.842024 0.253068 1.821318
H -4.687575 1.328226 1.108662
H 8.119085 0.279013 -1.935230
H 8.091396 -1.487211 -1.573850
H 10.466073 -0.685774 -1.946791
H 10.273809 0.508711 -0.624756
H 10.244403 -1.242200 -0.257861
H -5.221697 -1.161316 -0.669229
H -9.374880 0.345322 -0.536979
H -9.315387 -0.681489 0.924646
H -9.550129 -2.764060 -0.528230
H -9.611181 -1.735353 -1.991307
H -10.934340 -1.656840 -0.786375


