%chk=000087607.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087607

0 1
 O  -2.0900000E-02  0.2668000       1.914300    
 O   -2.405900     -0.9539000       1.890300    
 O  -0.7481000       2.562600      0.3013000    
 O   -4.435800     -0.3144000      0.2114000    
 O   -3.599700      -1.527400      -2.178700    
 O    1.869800       2.450300     -5.8100000E-02
 N    1.815500      0.3718000      -1.085300    
 C  -0.6909000      0.1814000      0.6497000    
 C   -2.198700      0.1058000      0.9449000    
 C  -0.2581000       1.347600     -0.2499000    
 C   -3.095800     -0.1597000     -0.2732000    
 C    1.251800       1.457300     -0.4396000    
 C   -2.723500      -1.414300      -1.060800    
 C    3.224200      0.2806000      -1.390900    
 C    4.021400     -0.3772000     -0.2695000    
 C    3.571800      -1.813700      7.1000000E-03
 C    4.422900      -2.463600       1.087000    
 H  -0.3474000     -0.7660000      0.2207000    
 H   -2.529600       1.015300       1.460500    
 H  -0.7103000       1.231500      -1.241900    
 H   -3.093500      0.7129000     -0.9364000    
 H   -1.705700      -1.360200      -1.454000    
 H   -2.826900      -2.323500     -0.4599000    
 H    3.319300     -0.2951000      -2.317700    
 H    3.614000       1.287100      -1.578400    
 H    1.218800     -0.3953000      -1.380400    
 H    3.924600      0.2158000      0.6484000    
 H    5.083100     -0.3732000     -0.5443000    
 H  -0.2903000     -0.5053000       2.440900    
 H   -3.358200     -0.9877000       2.085200    
 H    3.641100      -2.408300     -0.9111000    
 H    2.523800      -1.830100      0.3273000    
 H  -0.5858000       3.265700     -0.3507000    
 H   -5.029600     -0.2955000     -0.5580000    
 H    4.351600      -1.909700       2.028500    
 H    4.085700      -3.488700       1.269400    
 H    5.475400      -2.500500      0.7882000    
 H   -4.478500      -1.768000      -1.840100    


%chk=000087607-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087607

0 1
O 0.156799 -1.464550 0.363540
O -2.401061 -1.980086 0.874298
O -0.696552 1.732793 0.264884
O -4.475464 -0.144961 0.868752
O -5.094376 0.099609 -1.803046
O 1.716945 2.063853 -0.881781
N 1.974380 -0.242614 -1.198692
C -0.852191 -0.659085 -0.355348
C -2.099136 -0.572110 0.542827
C -0.292811 0.732458 -0.727592
C -3.338193 0.103912 -0.074410
C 1.243590 0.877122 -0.928878
C -3.815513 -0.488831 -1.410031
C 3.431079 -0.171698 -1.436874
C 4.262796 -0.143324 -0.131713
C 4.087837 -1.397990 0.754642
C 4.967773 -1.347257 2.022383
H -1.116386 -1.200706 -1.287737
H -1.822143 -0.020341 1.462320
H -0.742214 1.008119 -1.709003
H -3.157929 1.189654 -0.172062
H -3.111437 -0.235128 -2.220242
H -3.886031 -1.593252 -1.324733
H 3.713765 -1.046118 -2.053217
H 3.627810 0.744612 -2.019840
H 1.555290 -1.131220 -0.884281
H 3.989824 0.763503 0.441222
H 5.330891 -0.035095 -0.411364
H -0.348940 -2.200467 0.805154
H -3.285349 -1.983946 1.327297
H 4.340594 -2.304106 0.164966
H 3.023929 -1.495003 1.049612
H -0.010501 2.458674 0.189817
H -4.495850 0.566893 1.555301
H 4.716278 -0.465151 2.640549
H 4.829212 -2.248745 2.646933
H 6.040422 -1.278017 1.759936
H -5.685538 0.029797 -1.007389


