%chk=000037800.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037800

0 1
 O    2.247900       4.043700      0.1550000    
 O  -0.1304000       3.701000      0.2901000    
 O  -0.7374000      -2.887000       1.216500    
 O    6.133300      -1.577400      -1.198700    
 O    4.039900      -1.396000      -2.062400    
 N   0.6538000      -1.211000      0.5263000    
 C    2.281400      0.3688000      0.3593000    
 C   0.8883000      0.1728000      0.4377000    
 C    2.885400     -0.9076000      0.4010000    
 C    1.885200      -1.841700      0.5013000    
 C    2.814800       1.674700      0.2605000    
 C  -2.0999999E-03   1.269400      0.4198000    
 C    4.335700      -1.188400      0.3299000    
 C    1.918100       2.725500      0.2452000    
 C   0.5649000       2.528700      0.3220000    
 C    2.065000      -3.313900      0.4793000    
 C  -0.6115000      -1.825700      0.6223000    
 C   0.9436000       4.656200      0.1825000    
 C    4.794800      -1.380100      -1.098300    
 C   -1.756900      -1.155200     -8.9999996E-03
 C   -2.967800      -1.337100      0.5266000    
 C   -4.211100     -0.7428000      4.1999999E-03
 C   -4.137300      0.3645000     -0.8251000    
 C   -5.429300      -1.303100      0.3526000    
 C   -5.314000      0.9273000      -1.319300    
 C   -6.606100     -0.7404000     -0.1418000    
 C   -6.548300      0.3749000     -0.9778000    
 H    3.883600       1.849700      0.1971000    
 H   -1.073800       1.173500      0.5218000    
 H    4.592300      -2.086800      0.9015000    
 H    4.904300     -0.3552000      0.7583000    
 H    1.940800      -3.726200       1.485800    
 H    1.335000      -3.789900     -0.1838000    
 H    3.052900      -3.610900      0.1155000    
 H   0.8938000       5.338900       1.038500    
 H   0.8077000       5.235400     -0.7380000    
 H   -1.574000     -0.5746000     -0.9043000    
 H   -3.089900      -1.957100       1.412400    
 H    6.413500      -1.719600      -2.127900    
 H   -3.201300      0.8399000      -1.100600    
 H   -5.490700      -2.172600       1.001700    
 H   -5.270000       1.798600      -1.966400    
 H   -7.567300      -1.170400      0.1239000    
 H   -7.464600      0.8137000      -1.361700    


%chk=000037800-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037800

0 1
O 2.607359 4.058153 0.237492
O 0.250926 3.889808 0.634358
O -0.788863 -2.824879 1.470688
O 5.389849 -0.187147 -1.574844
O 4.695777 -2.361365 -2.014644
N 0.651944 -1.157826 0.662758
C 2.396773 0.313607 0.354862
C 0.976451 0.225868 0.539985
C 2.925265 -1.040622 0.395528
C 1.864580 -1.921214 0.592046
C 3.046475 1.574033 0.214606
C 0.153467 1.377036 0.668046
C 4.386427 -1.407994 0.256020
C 2.218504 2.690820 0.292489
C 0.821784 2.593543 0.522254
C 1.882801 -3.421013 0.647415
C -0.651560 -1.731152 0.846036
C 1.333938 4.818149 0.216556
C 4.822323 -1.419052 -1.205105
C -1.776778 -1.010914 0.208599
C -3.070285 -1.369504 0.486011
C -4.293622 -0.810959 -0.100155
C -4.288687 0.211359 -1.095727
C -5.550765 -1.313725 0.345814
C -5.496719 0.708863 -1.619121
C -6.760790 -0.815614 -0.178951
C -6.738423 0.198793 -1.163996
H 4.122732 1.654737 0.048459
H -0.911351 1.343834 0.901455
H 4.572100 -2.415454 0.662081
H 5.013655 -0.687897 0.808836
H 1.607609 -3.799609 1.646286
H 1.159788 -3.863029 -0.061350
H 2.885093 -3.790384 0.375828
H 1.395852 5.643592 0.941594
H 1.133618 5.162299 -0.816818
H -1.535783 -0.236686 -0.526172
H -3.202351 -2.167768 1.231446
H 5.620285 -0.207134 -2.543728
H -3.338710 0.615878 -1.462123
H -5.568608 -2.100674 1.109688
H -5.477166 1.493892 -2.382958
H -7.716601 -1.215099 0.176628
H -7.676113 0.588950 -1.574671


