%chk=000012083.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012083

0 1
 O   -3.065500     -0.8848000     -3.0000001E-04
 O   -3.064200       1.417100     -1.0000000E-03
 O    3.888300      0.8946000     -2.7999999E-03
 O    3.700400      -1.292600     -6.0000003E-04
 N    3.188300     -0.1469000     -1.0000000E-03
 C   -1.005700      0.2141000      1.6000000E-03
 C    1.773800     -2.5200000E-02  1.0000000E-03
 C  -0.2072000       1.357800      1.4000000E-03
 C  -0.4144000      -1.049300      1.7000000E-03
 C    1.182500       1.238100      8.9999998E-04
 C   0.9753000      -1.168900      1.4000000E-03
 C   -2.454500      0.3395000      5.0000002E-04
 C   -4.497100     -0.8936000     -2.7999999E-03
 H  -0.6478000       2.351400      1.2000001E-03
 H  -0.9963000      -1.966800      1.6000000E-03
 H    1.773000       2.150800      3.9999999E-04
 H    1.401700      -2.168900      1.0000000E-03
 H   -4.831200      -1.934400     -2.7999999E-03
 H   -4.875400     -0.4015000     -0.9037000    
 H   -4.878600     -0.4006000      0.8962000    


%chk=000012083-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000012083

0 1
O -3.132167 -0.919239 -0.002365
O -3.092723 1.410970 -0.001848
O 3.954579 0.980985 0.004322
O 3.805555 -1.294947 0.003146
N 3.277498 -0.117422 0.002870
C -0.994827 0.161781 -0.003052
C 1.792777 -0.019790 0.000814
C -0.208596 1.343234 -0.001165
C -0.370837 -1.112820 -0.002840
C 1.195323 1.260065 0.000724
C 1.033133 -1.210199 -0.000955
C -2.483097 0.314432 -0.005332
C -4.614106 -0.862052 0.000481
H -0.717764 2.311825 -0.001368
H -0.992155 -2.011599 -0.004296
H 1.828613 2.150576 0.002118
H 1.545995 -2.175134 -0.000801
H -4.934813 -1.912604 0.002749
H -4.975224 -0.335482 -0.898562
H -4.971762 -0.332680 0.899260


