%chk=000095091.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095091

0 1
 O    1.674300      -1.190600      -1.601400    
 O   -6.102300       1.345300     -0.7023000    
 O  -0.4172000      -3.895900     -0.3774000    
 O   -1.514500       3.128700     -0.2412000    
 O  -0.3060000       1.465800      0.5290000    
 N    2.586000     -0.4769000      0.4413000    
 N  -0.6597000      -1.275900      2.9400000E-02
 N   -1.262100     -0.7751000       1.001200    
 N   -1.400000       1.941600      0.1445000    
 C   0.6181000      -1.867300      0.4350000    
 C    3.699800      0.2980000      3.7099998E-02
 C    4.134000       1.355700      0.8197000    
 C    1.678200      -1.142400     -0.3739000    
 C    4.335800     -2.8300000E-02  -1.150400    
 C    5.233300       2.107200      0.4041000    
 C   0.5547000      -3.357300      0.1517000    
 C    3.456700       1.717200       2.101800    
 C   -2.477600     -0.2204000      0.5668000    
 C    5.435000      0.7232000      -1.565800    
 C    5.883700       1.790900     -0.7886000    
 C   -2.551400       1.105800      0.1464000    
 C   -3.616500      -1.022400      0.5625000    
 C   -3.770400       1.632600     -0.2805000    
 C   -4.912600      0.8319000     -0.2859000    
 C    1.765700      -4.166500      0.5434000    
 C   -4.835600     -0.4956000      0.1355000    
 C   -7.229600      0.4709000     -0.6821000    
 H   0.7898000      -1.756400       1.513800    
 H    2.322800     -0.3771000       1.418000    
 H    4.040000     -0.8725000      -1.763900    
 H    5.597100       2.941600      0.9978000    
 H    3.568200      0.9113000       2.834700    
 H    3.884800       2.622900       2.545500    
 H    2.392800       1.915500       1.935200    
 H    5.947100      0.4722000      -2.490200    
 H    6.740900       2.374600      -1.111100    
 H   -3.566300      -2.057800      0.8897000    
 H   -3.865700       2.663000     -0.6152000    
 H    1.558700      -5.230700      0.3989000    
 H    1.995600      -3.997000       1.598300    
 H    2.617800      -3.883800     -7.9099998E-02
 H   -5.682600      -1.172800      0.1570000    
 H   -7.468500      0.1458000      0.3362000    
 H   -8.089400       1.043700      -1.044600    
 H   -7.096400     -0.3733000      -1.367000    


%chk=000095091-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095091

0 1
O 2.652269 -2.468782 -0.933165
O -5.966886 1.556540 -0.338298
O -0.579445 -4.274012 0.500524
O -1.873471 3.096710 2.050202
O -0.226792 1.804296 1.139846
N 2.362017 -0.454315 0.255309
N -0.421398 -1.617148 0.059581
N -0.928262 -0.716213 0.841081
N -1.474325 2.087414 1.351586
C 0.772443 -2.264287 0.677827
C 3.442364 0.344972 -0.241149
C 3.778715 1.528333 0.490153
C 2.035593 -1.755010 -0.091620
C 4.155967 -0.009738 -1.415502
C 4.823545 2.340303 -0.009279
C 0.574494 -3.801424 0.655644
C 3.060962 1.904510 1.775212
C -2.149095 -0.133563 0.389168
C 5.196681 0.820857 -1.880463
C 5.532269 2.002441 -1.184057
C -2.488891 1.203794 0.750362
C -3.141763 -0.913439 -0.257029
C -3.761419 1.741109 0.507220
C -4.735704 0.940238 -0.136011
C 1.791248 -4.663685 0.907635
C -4.418265 -0.390457 -0.526639
C -7.018309 0.791610 -1.024050
H 0.865354 -1.962274 1.746443
H 1.726189 0.015734 0.910206
H 3.897908 -0.929259 -1.943157
H 5.088210 3.250500 0.541536
H 3.131722 1.099655 2.533368
H 3.512155 2.808452 2.216702
H 1.987613 2.123838 1.618633
H 5.741092 0.540353 -2.788700
H 6.338537 2.650259 -1.544597
H -2.887363 -1.946200 -0.517263
H -3.992882 2.769384 0.794067
H 1.477944 -5.694383 1.133804
H 2.409375 -4.261591 1.732077
H 2.426982 -4.648183 0.002735
H -5.158487 -1.020059 -1.027971
H -7.291238 -0.112989 -0.448402
H -7.877439 1.474980 -1.073034
H -6.703715 0.510128 -2.046636


