%chk=000048189.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048189

0 1
 O    2.596100      0.3423000      0.2803000    
 O    1.236200       1.137900      -1.399900    
 N  -0.4589000      -4.103900      6.8000001E-03
 C   0.3408000     -0.3627000      0.3118000    
 C   0.3967000      -1.815400     -0.2090000    
 C   -1.031300      0.2836000      0.1953000    
 C  -0.5447000      -2.753300      0.5520000    
 C    1.410700      0.4681000     -0.3902000    
 C   -1.433800       1.176200       1.168200    
 C   -1.833400     -4.1099999E-02 -0.8802000    
 C   -2.691900       1.769000       1.061400    
 C   -3.091400      0.5518000     -0.9870000    
 C   -3.520700       1.456900     -1.6100001E-02
 C    3.699400       1.067100     -0.2729000    
 C    4.926400      0.8237000      0.5796000    
 H   0.5966000     -0.3865000       1.381300    
 H   0.2097000      -1.861800      -1.288900    
 H    1.425800      -2.183500     -8.8299997E-02
 H  -0.2740000      -2.779200       1.613000    
 H   -1.586600      -2.428700      0.4906000    
 H  -0.7945000       1.427300       2.009000    
 H   -1.526400     -0.7200000      -1.667000    
 H   -3.025800       2.474500       1.816700    
 H   -3.735000      0.3136000      -1.828800    
 H   0.5054000      -4.431300      5.3300001E-02
 H  -0.7018000      -4.089100     -0.9831000    
 H   -4.499600       1.919700     -0.1002000    
 H    3.885500      0.7230000      -1.296400    
 H    3.463700       2.137100     -0.2856000    
 H    5.790900       1.364100      0.1842000    
 H    4.749100       1.146100       1.610900    
 H    5.163900     -0.2446000      0.6169000    


%chk=000048189-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048189

0 1
O 2.565155 0.501671 0.231320
O 1.700282 -0.127756 -1.838255
N -1.062154 -4.352861 0.193869
C 0.503840 -0.749743 0.245842
C 0.237952 -2.202672 -0.255488
C -0.752735 0.131133 0.186539
C -0.766837 -2.977008 0.639883
C 1.619005 -0.116934 -0.586487
C -1.327231 0.635938 1.379506
C -1.367661 0.439169 -1.055129
C -2.499575 1.424857 1.338527
C -2.537651 1.228718 -1.097085
C -3.110305 1.722370 0.098894
C 3.686304 1.203296 -0.472132
C 4.584475 1.790922 0.611167
H 0.855402 -0.785514 1.292940
H -0.137666 -2.164412 -1.295764
H 1.197656 -2.758075 -0.284247
H -0.375357 -3.026036 1.675321
H -1.721263 -2.421904 0.692663
H -0.856023 0.409196 2.343762
H -0.914756 0.078157 -1.985783
H -2.933679 1.804988 2.270226
H -3.000880 1.462722 -2.062420
H -0.247078 -4.975066 0.184563
H -1.582176 -4.400607 -0.688396
H -4.018617 2.334388 0.064448
H 4.210594 0.467354 -1.108244
H 3.249221 1.976495 -1.129457
H 5.432436 2.325623 0.145474
H 4.026760 2.505513 1.240117
H 4.989660 0.996976 1.261525


