%chk=000043135.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043135

0 1
 O   -1.361800       2.102600      0.3192000    
 N   -5.781500     -0.4302000      0.2971000    
 C   -6.762000      -1.515400      0.2955000    
 C   -6.168400      0.4327000     -0.8187000    
 C   -8.073800     -0.7884000      3.9200000E-02
 C   -7.684000      0.4902000     -0.6962000    
 C   -4.414900     -0.9159000      0.1759000    
 C   -3.421700      0.2405000      0.2444000    
 C   -1.964600     -0.2269000      0.1676000    
 C  -0.9855000      0.9368000      0.2213000    
 C   0.4769000      0.6468000      0.1484000    
 C   0.8849000     -0.6626000      3.5399999E-02
 C    1.360400       1.700700      0.1969000    
 C    3.172700      0.1133000      1.4300000E-02
 C    2.251600     -0.9330000     -3.2499999E-02
 C    2.727200       1.430100      0.1290000    
 C    4.590600     -0.1666000     -5.5599999E-02
 C    5.315300     -0.3924000       1.114700    
 C    5.232700     -0.2112000      -1.293200    
 C    6.682000     -0.6625000       1.047500    
 C    6.599600     -0.4814000      -1.360200    
 C    7.324200     -0.7071000     -0.1899000    
 H   -6.780800      -2.057100       1.246400    
 H   -6.572600      -2.233500     -0.5126000    
 H   -5.891300     -1.1000000E-03  -1.788200    
 H   -5.746000       1.439700     -0.7485000    
 H   -8.570100     -0.5360000      0.9836000    
 H   -8.764000      -1.400800     -0.5497000    
 H   -8.163600      0.5549000      -1.678200    
 H   -7.996000       1.363500     -0.1114000    
 H   -4.269600      -1.477700     -0.7560000    
 H   -4.203200      -1.605700       1.002600    
 H   -3.572300      0.8040000       1.174800    
 H   -3.589400      0.9444000     -0.5796000    
 H   -1.765200     -0.8954000       1.012500    
 H   -1.819700     -0.7666000     -0.7749000    
 H   0.2056000      -1.506000     -4.1000000E-03
 H    1.034900       2.732300      0.2861000    
 H    2.582700      -1.965200     -0.1215000    
 H    3.432000       2.257500      0.1668000    
 H    4.830400     -0.3615000       2.087600    
 H    4.682800     -3.7799999E-02  -2.215300    
 H    7.246400     -0.8383000       1.958600    
 H    7.099800     -0.5162000      -2.323600    
 H    8.388300     -0.9175000     -0.2422000    


%chk=000043135-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043135

0 1
O -1.379610 2.061396 0.733973
N -5.875652 -0.505506 0.138118
C -6.841986 -1.605898 -0.112551
C -6.402896 0.647337 -0.639313
C -8.220519 -0.909013 -0.007894
C -7.940159 0.574771 -0.427132
C -4.470871 -0.863286 -0.134949
C -3.482376 0.240426 0.289367
C -2.021871 -0.205229 0.098600
C -1.002249 0.898955 0.398807
C 0.462058 0.580015 0.281463
C 0.946633 -0.698974 -0.105020
C 1.407778 1.603030 0.564625
C 3.279851 0.077269 0.078413
C 2.329206 -0.943490 -0.204483
C 2.786818 1.357156 0.465385
C 4.743006 -0.184044 -0.025529
C 5.665128 0.465792 0.841871
C 5.257474 -1.089612 -0.995063
C 7.050632 0.218252 0.744423
C 6.642817 -1.336846 -1.094466
C 7.547362 -0.684454 -0.224601
H -6.707089 -2.417681 0.624980
H -6.709332 -2.046495 -1.136285
H -6.155267 0.545889 -1.729243
H -5.967949 1.596747 -0.283378
H -8.588581 -0.948266 1.031514
H -8.972945 -1.396831 -0.651987
H -8.480802 0.858934 -1.346947
H -8.256071 1.266249 0.372254
H -4.313832 -1.098907 -1.224786
H -4.246179 -1.791802 0.428149
H -3.664213 0.502973 1.347230
H -3.654845 1.163957 -0.292411
H -1.797951 -1.080130 0.744211
H -1.859902 -0.554935 -0.943703
H 0.246911 -1.513187 -0.320894
H 1.025995 2.588448 0.851803
H 2.679278 -1.946312 -0.472970
H 3.494196 2.171179 0.658060
H 5.292631 1.143845 1.617968
H 4.571888 -1.577510 -1.697054
H 7.741590 0.722274 1.429293
H 7.017629 -2.030302 -1.855528
H 8.623266 -0.876181 -0.301023


