%chk=000063234.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063234

0 1
 O  -0.3717000      -2.037300      2.2900000E-02
 O    1.652300      9.8499998E-02   2.270300    
 N   6.0199998E-02  0.2771000     -5.5700000E-02
 N   -1.777500       1.785900     -0.1407000    
 C    1.479900      6.3900001E-02 -0.1228000    
 C   -2.213800     -0.6158000     -1.7600000E-02
 C  -0.5013000       1.555700     -9.3199998E-02
 C  -0.7581000     -0.8709000      5.7000001E-03
 C   -2.660700      0.7019000     -0.1148000    
 C    2.233100     -1.8700000E-02   1.042700    
 C    2.084800     -5.7700001E-02  -1.368600    
 C    4.224400     -0.3489000     -0.2849000    
 C    3.609900     -0.2259000      0.9613000    
 C   -3.124900      -1.677600      3.0800000E-02
 C    3.461700     -0.2649000      -1.449800    
 C   0.3870000       2.780700     -1.8400000E-02
 C   -4.037700      0.9486000     -0.1629000    
 C   -4.493800      -1.418100     -1.7200001E-02
 C   -4.950600     -0.1060000     -0.1151000    
 C    5.696600     -0.5706000     -0.3720000    
 H    1.499200      7.0000002E-03  -2.281800    
 H    4.199900     -0.2890000       1.872600    
 H   -2.789500      -2.708400      0.1032000    
 H    3.928900     -0.3573000      -2.426700    
 H    1.083000       2.787800     -0.8616000    
 H   0.9582000       2.765800      0.9139000    
 H  -0.2108000       3.696200     -5.0200000E-02
 H   -4.408700       1.968400     -0.2343000    
 H   -5.203800      -2.239100      2.0099999E-02
 H   -6.016800      9.7000003E-02 -0.1525000    
 H    6.220000      0.3902000     -0.4000000    
 H    6.060700      -1.144400      0.4870000    
 H    5.958900      -1.139000      -1.270800    
 H   0.6985000      0.2443000       2.148400    


%chk=000063234-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063234

0 1
O -0.303603 -2.074688 0.007201
O 1.635072 0.071623 2.308358
N 0.020410 0.257718 -0.066817
N -1.821234 1.818401 -0.094108
C 1.459551 0.052345 -0.152015
C -2.263172 -0.629506 -0.037983
C -0.521061 1.572824 -0.095624
C -0.818190 -0.922385 -0.030355
C -2.714108 0.728922 -0.070684
C 2.220927 -0.034231 1.041404
C 2.104353 -0.075532 -1.398614
C 4.274542 -0.324870 -0.269449
C 3.618612 -0.215529 0.978525
C -3.201713 -1.694529 -0.013156
C 3.499940 -0.260728 -1.460169
C 0.449360 2.727975 -0.116020
C -4.111034 0.995736 -0.079983
C -4.578162 -1.415865 -0.022631
C -5.030507 -0.065970 -0.056330
C 5.781781 -0.497303 -0.333426
H 1.503543 -0.041201 -2.313972
H 4.175387 -0.280836 1.918861
H -2.820596 -2.720654 0.012557
H 3.991863 -0.364260 -2.433416
H 1.088043 2.707364 -1.016670
H 1.126287 2.706998 0.757467
H -0.133422 3.659759 -0.103344
H -4.434820 2.040453 -0.105396
H -5.304833 -2.234733 -0.003887
H -6.105360 0.145811 -0.063247
H 6.291810 0.485307 -0.357483
H 6.165147 -1.044608 0.545022
H 6.086131 -1.047871 -1.240399
H 0.646557 0.053462 2.233082


