%chk=000019060.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019060

0 1
 O    5.270200      0.6104000      0.4838000    
 O   -2.151900       1.927300     -0.2920000    
 O   -1.305300       1.562300       1.826300    
 N    1.326100     -0.9836000      0.5465000    
 C   -1.558300     -0.2794000      0.2716000    
 C  -0.9870000      -1.143200       1.425100    
 C  -0.5604000     -0.3426000     -0.9132000    
 C   0.4851000     -0.8485000       1.739100    
 C   0.8896000     -5.9000000E-02 -0.5040000    
 C    2.731300     -0.7532000      0.8811000    
 C    3.606500     -0.9294000     -0.3572000    
 C    5.072300     -0.7167000     -3.2099999E-02
 C   -2.983900     -0.7341000     -8.3499998E-02
 C   -1.645000       1.166200      0.7195000    
 C    5.985200     -0.8419000      -1.239600    
 C    7.157100      9.4999997E-03 -0.8196000    
 C    6.472700       1.145300     -8.9100003E-02
 C   -3.981600     -0.7056000      0.8873000    
 C   -3.269900      -1.171500      -1.374100    
 C   -5.274700      -1.117800      0.5654000    
 C   -4.563000      -1.583600      -1.696000    
 C   -5.565400      -1.556700     -0.7262000    
 C   -2.289100       3.322100     -2.7000001E-03
 C   -2.860400       4.023600      -1.216500    
 H   -1.564400      -1.011200       2.349200    
 H   -1.080700      -2.206100       1.159600    
 H  -0.5686000      -1.351100      -1.350900    
 H  -0.8365000      0.3516000      -1.717400    
 H   0.8104000      -1.575700       2.494100    
 H   0.6046000      0.1408000       2.194500    
 H    1.002600      0.9874000     -0.1929000    
 H    1.454100     -0.1907000      -1.430500    
 H    3.049100      -1.477500       1.641500    
 H    2.868100      0.2488000       1.307800    
 H    3.363100     -0.1828000      -1.118800    
 H    3.460300      -1.924500     -0.7941000    
 H    5.392900      -1.416900      0.7497000    
 H    6.257900      -1.877500      -1.460500    
 H    5.521100     -0.4106000      -2.134800    
 H    7.775900      0.3498000      -1.653800    
 H    7.794500     -0.5515000     -0.1260000    
 H    7.097500       1.574400      0.6993000    
 H    6.184500       1.944300     -0.7803000    
 H   -3.779700     -0.3617000       1.897700    
 H   -2.535400      -1.203300      -2.170200    
 H   -6.055600      -1.095400       1.319800    
 H   -4.791100      -1.923000      -2.702300    
 H   -6.572500      -1.876500     -0.9773000    
 H   -2.962400       3.452900      0.8518000    
 H   -1.306800       3.742500      0.2400000    
 H   -2.979000       5.094400      -1.029800    
 H   -2.206600       3.885600      -2.084000    
 H   -3.834700       3.600400      -1.482500    


%chk=000019060-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019060

0 1
O 5.348793 0.826181 0.248670
O -1.960836 2.060085 -0.233387
O -2.098368 1.393830 1.985034
N 1.269482 -0.794417 0.456110
C -1.678533 -0.322805 0.223869
C -1.035215 -1.204231 1.340485
C -0.706962 -0.308202 -0.986863
C 0.408095 -0.774904 1.667299
C 0.716401 0.115533 -0.577973
C 2.686277 -0.489883 0.789769
C 3.670021 -0.902712 -0.323482
C 5.133088 -0.647344 0.066218
C -3.090342 -0.863084 -0.130763
C -1.911129 1.103654 0.778882
C 6.174201 -1.093927 -0.988439
C 7.322350 -0.068147 -0.813771
C 6.544438 1.233201 -0.528636
C -4.079605 -0.944083 0.886753
C -3.432981 -1.290831 -1.437649
C -5.367501 -1.447373 0.607965
C -4.722575 -1.798828 -1.717946
C -5.695619 -1.881571 -0.697689
C -2.284073 3.456232 0.197049
C -2.259728 4.319199 -1.060116
H -1.643162 -1.155985 2.260123
H -1.031973 -2.249867 0.980492
H -0.651909 -1.333942 -1.397907
H -1.079637 0.369107 -1.774535
H 0.834367 -1.477777 2.407455
H 0.392710 0.238077 2.145216
H 0.705900 1.178995 -0.219102
H 1.367471 0.084414 -1.469306
H 2.938170 -1.058218 1.707423
H 2.838930 0.591696 1.026734
H 3.466108 -0.345815 -1.257926
H 3.528264 -1.980373 -0.540053
H 5.351094 -1.121121 1.047724
H 6.501241 -2.136256 -0.834442
H 5.740254 -1.013700 -2.003729
H 7.970323 0.009065 -1.703883
H 7.950291 -0.339724 0.054476
H 7.106689 1.962807 0.079698
H 6.222789 1.720480 -1.472977
H -3.843764 -0.595677 1.899191
H -2.700603 -1.229307 -2.247598
H -6.115047 -1.498533 1.407777
H -4.965540 -2.127239 -2.735135
H -6.695027 -2.274370 -0.916049
H -3.274952 3.444445 0.686151
H -1.534697 3.770628 0.945771
H -2.498910 5.366530 -0.799758
H -1.263289 4.297865 -1.533781
H -3.002968 3.965024 -1.794640


