%chk=000003157.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003157

0 1
 O   -5.602600      0.7423000     -0.3960000    
 O   -5.598600      -1.699100       1.139900    
 O   -4.153900       2.465600      0.8658000    
 O    6.616400      -2.859500      0.3965000    
 O    8.100700     -0.6681000     -0.4494000    
 N   -2.220700       1.229000      0.5006000    
 N   0.6514000       1.036200      0.1966000    
 N    2.632000     -0.2548000      0.2616000    
 N    2.693100       2.060500     -0.4035000    
 N    4.725200       3.084700      -1.001700    
 C   -1.569000     -3.1099999E-02  0.1365000    
 C   -1.338300       2.352200      0.8054000    
 C  -0.1290000     -0.1206000      0.6425000    
 C  -5.0700001E-02   2.305300     -1.4300000E-02
 C   -3.603700       1.405300      0.5594000    
 C   -4.435300      0.2108000      0.2295000    
 C    2.029300      0.9470000      1.2900000E-02
 C   -4.808500     -0.5571000       1.483100    
 C   -6.599000     -0.1951000     -0.4876000    
 C    3.962000     -0.3482000      8.6800002E-02
 C   -6.591200      -1.383300      0.2485000    
 C    4.724200      0.7515000     -0.3402000    
 C    4.023100       1.932300     -0.5686000    
 C    4.628500      -1.547600      0.3257000    
 C   -7.656100      8.3300002E-02  -1.354300    
 C    6.114200      0.6420000     -0.5197000    
 C   -7.618300      -2.312800      8.5100003E-02
 C    6.010500      -1.664400      0.1495000    
 C    6.754400     -0.5686000     -0.2735000    
 C   -8.689800     -0.8411000      -1.506500    
 C   -8.668100      -2.039600     -0.7921000    
 C    6.731100      -3.777100     -0.6719000    
 C    8.936800     -0.3800000      0.6533000    
 H   -1.588900     -9.2000000E-02 -0.9585000    
 H   -2.130500     -0.8820000      0.5302000    
 H   -1.112700       2.296500       1.877500    
 H   -1.860300       3.299000      0.6307000    
 H  -0.1134000     -0.1599000       1.738400    
 H   0.2949000      -1.060100      0.2691000    
 H  -0.2753000       2.416400      -1.082000    
 H   0.5676000       3.157700      0.2910000    
 H   -3.954600     -0.4300000     -0.5170000    
 H   -3.921000     -0.9147000       2.014700    
 H   -5.381200      6.1799999E-02   2.186900    
 H    4.062100      -2.416200      0.6585000    
 H   -7.676400       1.010200      -1.921000    
 H    6.718900       1.478900     -0.8584000    
 H   -7.614100      -3.244700      0.6439000    
 H   -9.510700     -0.6297000      -2.185600    
 H   -9.472400      -2.759000     -0.9160000    
 H    4.156300       3.905000      -1.177400    
 H    5.652600       3.251800     -0.6323000    
 H    7.242200      -4.672600     -0.3076000    
 H    7.320800      -3.350700      -1.489800    
 H    5.742200      -4.068400      -1.040200    
 H    8.732500      -1.061700       1.485200    
 H    8.802400      0.6560000      0.9807000    
 H    9.977400     -0.5133000      0.3445000    


%chk=000003157-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003157

0 1
O -4.329377 0.064837 -0.065868
O -6.941918 -0.288934 1.192719
O -4.180861 2.793084 2.012051
O 6.150438 -3.005514 -0.280396
O 7.554308 -0.773132 -1.521429
N -2.324799 1.446997 1.592073
N 0.510155 1.257059 1.034670
N 2.352542 -0.148414 0.620617
N 2.329628 2.196222 -0.106346
N 4.098802 3.188032 -1.231082
C -1.693641 0.152314 1.208074
C -1.403817 2.582614 1.859007
C -0.221073 0.134403 1.649530
C -0.195054 2.552569 0.911996
C -3.683947 1.670888 1.665207
C -4.611123 0.489361 1.332891
C 1.776304 1.078053 0.503878
C -6.087080 0.890522 1.457341
C -5.301289 -0.830902 -0.585109
C 3.619496 -0.280933 0.078380
C -6.566756 -1.009163 0.037727
C 4.306663 0.814462 -0.570300
C 3.568703 2.067105 -0.630848
C 4.271667 -1.551468 0.143161
C -4.975120 -1.552716 -1.750418
C 5.621751 0.619805 -1.081036
C -7.485412 -1.936371 -0.495538
C 5.547841 -1.733539 -0.392240
C 6.251324 -0.623799 -0.986896
C -5.903328 -2.469490 -2.290053
C -7.154154 -2.668677 -1.655693
C 6.463019 -3.663346 -1.572422
C 8.597907 -1.065674 -0.508740
H -1.765790 0.005277 0.115852
H -2.227922 -0.685973 1.691143
H -1.065501 2.550954 2.913646
H -1.977645 3.514554 1.727095
H -0.151498 0.178086 2.756189
H 0.268586 -0.798428 1.326795
H -0.523144 2.718311 -0.134012
H 0.497483 3.374267 1.162950
H -4.414706 -0.376946 2.001214
H -6.332162 1.218175 2.476940
H -6.324064 1.699273 0.743517
H 3.751695 -2.392901 0.607811
H -3.997128 -1.388010 -2.214101
H 6.195443 1.428537 -1.548134
H -8.451024 -2.059025 0.004984
H -5.648242 -3.027909 -3.196533
H -7.872979 -3.384708 -2.067163
H 3.529413 4.031780 -1.244704
H 5.006858 3.184104 -1.684013
H 6.972373 -4.601543 -1.305412
H 7.118013 -3.026107 -2.192729
H 5.525578 -3.885078 -2.116418
H 8.353994 -1.984829 0.053774
H 8.698191 -0.213028 0.189640
H 9.530877 -1.196886 -1.077836


