%chk=000090075.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090075

0 1
 O    2.263300       2.979200     -0.6807000    
 O    4.376500       1.607800      0.4893000    
 O   -5.213400       1.713300      0.6575000    
 N   0.7315000      -3.222900     -0.2526000    
 C  -0.4884000      -1.111600     -0.6848000    
 C  -0.5470000      -2.527200     -6.1400000E-02
 C   0.8013000     -0.3717000     -0.3513000    
 C    1.783800      -2.543900      0.5202000    
 C    1.892200      -1.072000      0.1977000    
 C   -1.758400     -0.3521000     -0.3244000    
 C   0.9553000      0.9899000     -0.6619000    
 C    3.082500     -0.3895000      0.4904000    
 C   0.6248000      -4.623900      0.1545000    
 C    2.148500       1.655600     -0.3794000    
 C    3.208700      0.9682000      0.2030000    
 C   -2.639800      3.5399999E-02  -1.328400    
 C   -2.027800     -5.2200001E-02   1.007100    
 C   -3.803000      0.7306000     -0.9977000    
 C   -3.191100      0.6428000       1.337800    
 C   -4.078600       1.034400      0.3354000    
 C    1.879100       3.909800      0.3296000    
 H  -0.4613000      -1.249500      -1.776500    
 H  -0.7953000      -2.495800       1.008200    
 H   -1.357100      -3.083800     -0.5523000    
 H    2.744800      -3.020700      0.2887000    
 H    1.608300      -2.644700       1.599800    
 H   0.1430000       1.541300      -1.129600    
 H    3.917500     -0.9231000      0.9390000    
 H    1.574200      -5.145200     -1.0400000E-02
 H  -0.1271000      -5.142900     -0.4503000    
 H   0.3512000      -4.730400       1.210500    
 H   -2.438100     -0.1941000      -2.371000    
 H   -1.344600     -0.3406000       1.801000    
 H   -4.490400       1.033100      -1.783000    
 H   -3.393400      0.8752000       2.380000    
 H    4.307200       2.529300      0.1861000    
 H    2.469200       3.762100       1.239600    
 H   0.8124000       3.809500      0.5542000    
 H    2.063800       4.919500     -4.6900000E-02
 H   -5.243300       1.837100       1.621800    


%chk=000090075-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090075

0 1
O 2.533306 3.026933 0.120747
O 4.554035 1.462142 0.936704
O -5.291033 1.777216 0.741803
N 0.731141 -3.228166 -0.360900
C -0.421549 -1.040703 -0.590770
C -0.502976 -2.487777 -0.033905
C 0.892378 -0.380511 -0.151432
C 1.894831 -2.686258 0.370533
C 1.990913 -1.169088 0.275198
C -1.680236 -0.257213 -0.220201
C 1.036747 1.032292 -0.223465
C 3.209576 -0.542458 0.641558
C 0.603837 -4.685719 -0.188177
C 2.247103 1.642369 0.137860
C 3.346243 0.850528 0.577106
C -2.669542 0.026848 -1.196250
C -1.923406 0.161901 1.113478
C -3.863172 0.702064 -0.866378
C -3.110587 0.838661 1.463888
C -4.083410 1.105815 0.469200
C 1.470958 3.929304 -0.321371
H -0.393674 -1.138390 -1.695520
H -0.691790 -2.450759 1.071389
H -1.362613 -3.006475 -0.495689
H 2.813314 -3.143186 -0.046027
H 1.859196 -2.978075 1.456901
H 0.183956 1.633829 -0.553817
H 4.069766 -1.133602 0.973974
H 1.529790 -5.182499 -0.531237
H -0.233329 -5.062858 -0.801579
H 0.423611 -4.993514 0.874088
H -2.503433 -0.286791 -2.234407
H -1.166218 -0.026492 1.883393
H -4.625421 0.921398 -1.619850
H -3.278081 1.155692 2.502104
H 4.451456 2.443083 0.812269
H 0.584154 3.849825 0.336557
H 1.176762 3.713017 -1.366339
H 1.896182 4.941635 -0.255517
H -5.357785 2.002281 1.702879


