%chk=000095147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095147

0 1
 O   0.2917000      -1.045700      0.9500000    
 O   0.9540000      -1.155500      -1.276200    
 N    2.518000      -1.201900      0.4365000    
 C    4.275600      6.4999998E-02 -0.7464000    
 C    3.707400      -1.301200     -0.3771000    
 C    4.689500      0.8808000      0.4805000    
 C   -1.624800      0.2580000      0.2702000    
 C   -2.971900      0.2788000     -0.1629000    
 C   -1.006000     -0.9759000      0.5295000    
 C    5.307100       2.211500      7.9899997E-02
 C  -0.9363000       1.471400      0.4311000    
 C   -3.660500     -0.9346000     -0.3242000    
 C   -1.705300      -2.171800      0.3644000    
 C   -3.591000       1.512400     -0.4224000    
 C    1.241600      -1.136400     -8.3099999E-02
 C   -3.030000      -2.151200     -6.1999999E-02
 C   -1.567000       2.687900      0.1690000    
 C   -2.892000       2.708400     -0.2568000    
 H    3.532200      0.6296000      -1.323000    
 H    5.145100     -8.0899999E-02  -1.398600    
 H    4.442100      -1.882200      0.1902000    
 H    3.467500      -1.858500      -1.289200    
 H    5.413800      0.3138000       1.076800    
 H    3.821200       1.074100       1.120500    
 H    2.625700      -1.174400       1.445900    
 H    4.597100       2.816600     -0.4928000    
 H    5.596000       2.778500      0.9703000    
 H    6.202300       2.060500     -0.5318000    
 H   9.8399997E-02   1.494300      0.7655000    
 H   -4.696600     -0.9424000     -0.6563000    
 H   -1.222500      -3.124000      0.5673000    
 H   -4.625800       1.552300     -0.7564000    
 H   -3.573900      -3.082500     -0.1904000    
 H   -1.023700       3.619500      0.2983000    
 H   -3.382500       3.655800     -0.4605000    


%chk=000095147-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000095147

0 1
O 0.286348 -0.393095 0.378164
O 1.374535 -2.183028 -0.782685
N 2.498940 -0.709147 0.659107
C 4.747340 -0.422171 -0.455858
C 3.845404 -1.273457 0.468522
C 5.061109 0.987022 0.096228
C -1.939602 0.473624 0.245915
C -3.337583 0.330094 -0.106293
C -1.051755 -0.623745 -0.044844
C 6.009313 1.786106 -0.823846
C -1.495433 1.688162 0.863456
C -3.789543 -0.881063 -0.727357
C -1.505604 -1.798373 -0.650793
C -4.234505 1.413188 0.177392
C 1.400396 -1.204495 0.000376
C -2.889737 -1.913357 -0.990764
C -2.395738 2.724453 1.124278
C -3.777538 2.587018 0.779721
H 4.266924 -0.338239 -1.450196
H 5.697503 -0.974542 -0.606085
H 4.322725 -1.385602 1.461827
H 3.710763 -2.281522 0.040174
H 5.514760 0.892896 1.104856
H 4.116853 1.555021 0.223226
H 2.361397 0.105846 1.256991
H 5.567121 1.916071 -1.829234
H 6.219249 2.790820 -0.413953
H 6.975596 1.261984 -0.947730
H -0.438780 1.787874 1.125168
H -4.848351 -0.981238 -0.991784
H -0.810395 -2.607268 -0.876148
H -5.292115 1.301838 -0.090170
H -3.234569 -2.837212 -1.467490
H -2.044829 3.649253 1.595450
H -4.473698 3.406385 0.990177


