%chk=000035018.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035018

0 1
 O    3.440400      -1.691400     -2.7600000E-02
 O    1.955800       2.690100     -2.0800000E-02
 N   -1.130700     -0.7978000      5.2700002E-02
 N   0.3924000      0.9849000      1.7100001E-02
 N    1.162400      -1.287800      1.3700000E-02
 N    2.745200      0.5153000     -2.3200000E-02
 C   -3.573600     -0.7190000      3.2900002E-02
 C   -2.274600      8.1699997E-02  6.9300003E-02
 C   -4.816600      0.1740000      1.8000000E-03
 C   -6.090300     -0.6506000     -0.1006000    
 C   0.1820000     -0.3532000      2.7100001E-02
 C    2.406900     -0.7841000     -1.1000000E-02
 C    1.686800       1.341500     -7.7999998E-03
 C    3.079500      -3.065200     -1.6899999E-02
 C   0.8344000       3.561600     -6.6999998E-03
 H   -3.620100      -1.381800      0.9064000    
 H   -3.572000      -1.370200     -0.8508000    
 H   -2.254100      0.7027000      0.9728000    
 H   -2.240000      0.7513000     -0.7986000    
 H   -4.762100      0.8571000     -0.8537000    
 H   -4.853400      0.7896000      0.9080000    
 H   -1.272200      -1.801500      6.5600000E-02
 H   -6.189600      -1.326500      0.7548000    
 H   -6.966000      5.5999998E-03 -0.1188000    
 H   -6.096700      -1.251100      -1.015800    
 H    2.497800      -3.326800     -0.9073000    
 H    2.531600      -3.321600      0.8960000    
 H    4.000500      -3.655700     -3.2400001E-02
 H    1.206700       4.590400     -1.9700000E-02
 H   0.2440000       3.429500      0.9063000    
 H   0.2125000       3.418100     -0.8968000    


%chk=000035018-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035018

0 1
O 3.468084 -1.679731 0.000031
O 2.029649 2.687582 0.004967
N -1.138935 -0.792237 0.012768
N 0.376517 1.009789 0.008463
N 1.141992 -1.309229 0.006856
N 2.765215 0.510104 0.001128
C -3.613106 -0.742230 -0.019120
C -2.317530 0.090340 0.017451
C -4.877869 0.145776 -0.013028
C -6.181989 -0.679229 -0.041596
C 0.151053 -0.347122 0.009730
C 2.406499 -0.806394 0.002548
C 1.697724 1.353612 0.003421
C 3.147797 -3.123033 0.001204
C 0.915062 3.658962 0.010938
H -3.641484 -1.423394 0.856411
H -3.618703 -1.380708 -0.926338
H -2.296820 0.732332 0.919909
H -2.269717 0.771424 -0.854085
H -4.849960 0.826918 -0.887154
H -4.866314 0.791753 0.887811
H -1.262723 -1.805875 0.019296
H -6.249639 -1.346141 0.838302
H -7.071810 -0.024255 -0.037616
H -6.232357 -1.311854 -0.947561
H 2.564357 -3.392411 -0.895301
H 2.570265 -3.392307 0.901559
H 4.130832 -3.614883 -0.001965
H 1.414815 4.638068 0.012609
H 0.290345 3.528960 0.910566
H 0.285650 3.534513 -0.886203


