%chk=000041227.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041227

0 1
 O   -1.768200      -1.324100     -2.2299999E-02
 O    3.373600     -0.7183000      -1.218000    
 O   -4.035500     -0.8673000     -9.8999999E-03
 N   -2.474500      0.8626000      1.8800000E-02
 C    1.563200      0.2662000      3.0000000E-03
 C    3.023600     -4.2700000E-02 -5.1000002E-03
 C   -1.104800      0.8770000      1.7400000E-02
 C  -0.7003000     -0.4402000     -7.4999998E-03
 C   0.6352000     -0.7803000     -1.5300000E-02
 C    1.138400       1.610700      2.8300000E-02
 C  -0.2209000       1.932000      3.5799999E-02
 C    3.450100     -0.9135000       1.180000    
 C   -2.879900     -0.4621000     -5.2000000E-03
 H    3.607200      0.8852000      1.9400001E-02
 H   0.9399000      -1.820300     -4.3499999E-02
 H    1.867400       2.417500      4.2300001E-02
 H  -0.5542000       2.962500      5.5199999E-02
 H    3.013500      -1.916900       1.128400    
 H    3.167300     -0.4571000       2.134200    
 H    4.537000      -1.052900       1.171900    
 H   -3.072300       1.679400      3.4899998E-02
 H    4.331700     -0.8834000      -1.195100    


%chk=000041227-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041227

0 1
O -1.884712 -1.238148 -0.518767
O 3.193186 -1.375599 -0.998596
O -4.219334 -0.800154 -0.380355
N -2.549797 0.842096 0.128085
C 1.574653 0.165957 -0.090387
C 3.060086 -0.179277 -0.149635
C -1.139370 0.856611 0.133256
C -0.737241 -0.441463 -0.270373
C 0.599472 -0.820331 -0.393362
C 1.179399 1.470668 0.308193
C -0.182565 1.841092 0.428639
C 3.651278 -0.436290 1.256517
C -3.050335 -0.409413 -0.260860
H 3.603887 0.670187 -0.619009
H 0.903034 -1.814674 -0.725212
H 1.949620 2.221445 0.522156
H -0.466513 2.853277 0.731972
H 3.145513 -1.297396 1.727719
H 3.514912 0.444138 1.909412
H 4.736430 -0.649377 1.197994
H -3.170995 1.611806 0.365878
H 4.126892 -1.701154 -0.955565


