%chk=000015798.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015798

0 1
 O    2.599800      0.6236000     -0.7495000    
 O  -0.7694000      -2.569100     -0.6534000    
 O   -1.852000       1.944200     -0.7423000    
 O    1.886100      -1.871500       1.638500    
 O   0.7110000       2.523600       1.646300    
 O   -2.588600     -0.6322000       1.644100    
 N   0.9319000     -0.9961000     -0.7462000    
 N   0.3848000       1.309600     -0.7586000    
 N   -1.338200     -0.3169000     -0.7435000    
 N    3.253200      -3.447600      0.6725000    
 N    1.415800       4.501900      0.7106000    
 N   -4.630800      -1.058700      0.6779000    
 C    1.399800      0.3310000     -0.7539000    
 C  -0.4227000      -1.385200     -0.7126000    
 C  -0.9986000       1.051600     -0.7501000    
 C    1.933100      -2.058900     -0.7753000    
 C   0.8280000       2.701400     -0.7658000    
 C   -2.759100     -0.6539000     -0.7714000    
 C    2.319200      -2.434600      0.6369000    
 C   0.9830000       3.194400      0.6545000    
 C   -3.286300     -0.7569000      0.6412000    
 H    1.535600      -2.943700      -1.284400    
 H    2.828000      -1.725100      -1.311500    
 H    1.785000       2.802100      -1.289000    
 H   8.8900000E-02   3.328200      -1.276900    
 H   -3.323900      0.1157000      -1.308500    
 H   -2.913200      -1.612300      -1.279000    
 H    3.615400      -3.792500       1.555300    
 H    3.608000      -3.888600     -0.1700000    
 H    1.550500       4.969200       1.601000    
 H    1.620700       5.042100     -0.1240000    
 H   -5.116100      -1.172700       1.561500    
 H   -5.184900      -1.171700     -0.1651000    


%chk=000015798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015798

0 1
O 2.377332 1.275846 -0.929487
O -0.076419 -2.707862 -0.886397
O -2.299691 1.409535 -0.922026
O 3.801448 -1.515859 1.182858
O -0.554616 4.041537 1.177379
O -3.229807 -2.514494 1.193782
N 1.172134 -0.734391 -0.877805
N 0.044183 1.371371 -0.886926
N -1.215473 -0.658333 -0.874478
N 2.044873 -3.044733 1.043880
N 1.649522 3.300828 0.991156
N -3.674232 -0.231296 1.016031
C 1.271237 0.673498 -0.897542
C -0.045466 -1.448298 -0.876598
C -1.224527 0.752967 -0.893577
C 2.435829 -1.525054 -0.864556
C 0.097599 2.861049 -0.881407
C -2.532071 -1.357435 -0.863477
C 2.826844 -2.020475 0.556457
C 0.359759 3.454593 0.531964
C -3.172376 -1.427449 0.551940
H 2.304564 -2.376514 -1.552380
H 3.239026 -0.861647 -1.213776
H 0.886008 3.170705 -1.587055
H -0.885503 3.222983 -1.212704
H -3.197022 -0.828929 -1.566281
H -2.355473 -2.389976 -1.194937
H 2.244201 -3.409425 1.975640
H 1.251147 -3.404831 0.504015
H 1.883290 3.660036 1.917069
H 2.348287 2.791973 0.440085
H -4.099600 -0.207888 1.943079
H -3.581007 0.628366 0.465373


