%chk=000011281.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011281

0 1
 O    1.402900       2.319500     -0.8215000    
 O  -0.7431000       3.879300     -0.6302000    
 O    2.964100       1.093900      0.5027000    
 N   -2.708600      -2.198200      1.2500000E-02
 C   -1.324000      -1.715400      0.2548000    
 C   -1.160200     -0.2143000     -6.0000001E-03
 C  -0.2973000      -2.484700     -0.6072000    
 C   -2.288200      0.6293000     -7.6000001E-03
 C   -3.668800      -1.345400      0.7313000    
 C   0.1404000      0.3243000     -0.1803000    
 C   -3.672000      5.9599999E-02  0.1360000    
 C    1.105900      -1.963900     -0.3905000    
 C    1.310800     -0.5830000     -0.1814000    
 C   -2.130600       2.003400     -0.2119000    
 C   0.2590000       1.711500     -0.3805000    
 C   -2.893900      -3.589700      0.4383000    
 C  -0.8626000       2.541300     -0.3940000    
 C    2.630800     -0.1410000      1.9600000E-02
 C    2.192900      -2.850300     -0.4400000    
 C    3.707800      -1.031600     -1.3800000E-02
 C    3.489600      -2.384000     -0.2493000    
 C  -0.5481000       4.721000      0.5036000    
 C    3.093200       1.218600       1.915300    
 H   -1.076400      -1.864900       1.317300    
 H  -0.5371000      -2.394800      -1.675100    
 H  -0.3118000      -3.549800     -0.3520000    
 H   -3.430500      -1.306900       1.803100    
 H   -4.686000      -1.747000      0.6418000    
 H   -4.279500      0.7115000      0.7753000    
 H   -4.138300      3.7700001E-02 -0.8573000    
 H   -3.002700       2.652600     -0.2403000    
 H   -2.620100      -3.740800       1.488500    
 H   -2.312300      -4.278900     -0.1807000    
 H   -3.939100      -3.895700      0.3111000    
 H    2.031300      -3.910000     -0.6204000    
 H    4.720900     -0.6845000      0.1744000    
 H    4.326400      -3.075600     -0.2732000    
 H    1.236900       3.264500     -0.9787000    
 H   -1.414000       4.668900       1.171200    
 H  -0.4392000       5.750500      0.1517000    
 H   0.3604000       4.438200       1.045100    
 H    3.983100      0.6897000       2.270300    
 H    2.201700      0.8391000       2.425500    
 H    3.203200       2.279900       2.155000    


%chk=000011281-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000011281

0 1
O 1.802497 2.194968 -0.517600
O -0.186901 3.917615 -0.318928
O 3.343609 0.516202 1.179548
N -2.560014 -2.119004 0.262506
C -1.134454 -1.703877 0.314437
C -0.960225 -0.184346 0.282476
C -0.319072 -2.253796 -0.888046
C -2.056266 0.700364 0.344841
C -3.417676 -1.268714 1.123154
C 0.377875 0.297410 0.081888
C -3.460223 0.159817 0.562189
C 1.153686 -1.931854 -0.685594
C 1.488097 -0.685879 -0.052442
C -1.847243 2.096666 0.185922
C 0.551985 1.680934 -0.155336
C -2.737934 -3.554029 0.565843
C -0.556503 2.572138 -0.079625
C 2.851916 -0.487090 0.331593
C 2.157564 -2.839584 -1.073575
C 3.859562 -1.383749 -0.108258
C 3.519990 -2.539233 -0.830933
C -1.254207 4.916162 -0.348592
C 2.499759 1.031353 2.262968
H -0.652561 -2.097882 1.252098
H -0.722892 -1.788195 -1.809297
H -0.442077 -3.345910 -0.989602
H -3.054014 -1.249769 2.183520
H -4.434674 -1.702324 1.131637
H -4.023767 0.819283 1.251390
H -4.010625 0.143216 -0.399267
H -2.701335 2.779075 0.248880
H -2.384546 -3.832456 1.591618
H -2.191035 -4.177483 -0.160985
H -3.808387 -3.813744 0.488427
H 1.876382 -3.778538 -1.563960
H 4.893040 -1.165876 0.177675
H 4.305943 -3.230039 -1.155506
H 1.695183 3.170382 -0.683372
H -1.997342 4.677766 -1.133646
H -0.759335 5.871062 -0.579019
H -1.759521 4.984151 0.634033
H 1.788376 0.261628 2.616872
H 1.944730 1.927877 1.940780
H 3.199538 1.299201 3.071789


