%chk=000053177.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053177

0 1
 O  -6.9100000E-02   1.842300      3.9999999E-04
 O    2.151900       2.474700     -3.0000001E-04
 N    2.814100     -0.4660000     -1.1000000E-03
 N    1.277700      -2.083200      3.9999999E-04
 C  -0.7146000     -0.5357000      7.9999998E-04
 C   0.6833000     -0.8537000      6.9999998E-04
 C    1.602100      0.1692000      1.9999999E-04
 C   -1.066300      0.8215000      6.0000003E-04
 C   -1.716600      -1.503600      9.9999997E-05
 C    1.320300       1.575100       0.000000    
 C   -2.397800       1.226700     -9.9999997E-05
 C    2.567000      -1.814900     -3.9999999E-04
 C   -3.056700      -1.105100     -6.0000003E-04
 C   -3.395300      0.2527000     -7.9999998E-04
 H   -1.477300      -2.563500      9.9999997E-05
 H    3.724300     -2.5000000E-02 -1.9000000E-03
 H   -2.662000       2.279400     -3.9999999E-04
 H    3.367200      -2.541300     -8.9999998E-04
 H   -3.842300      -1.855800     -1.2000001E-03
 H   -4.440700      0.5481000     -1.4000000E-03


%chk=000053177-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053177

0 1
O -0.087418 1.838008 -0.000314
O 2.128225 2.535470 -0.000178
N 2.877546 -0.458666 -0.000123
N 1.327976 -2.128721 -0.000326
C -0.731239 -0.575676 -0.000375
C 0.681559 -0.884755 -0.000361
C 1.627143 0.161707 -0.000327
C -1.067496 0.813104 -0.000331
C -1.778626 -1.533214 -0.000322
C 1.327947 1.575121 -0.000446
C -2.409974 1.241644 -0.000276
C 2.647473 -1.829008 -0.000460
C -3.120445 -1.112550 -0.000268
C -3.434226 0.273073 -0.000254
H -1.511996 -2.594947 -0.000323
H 3.775453 0.026177 0.000085
H -2.627178 2.313430 -0.000243
H 3.450809 -2.561948 -0.000512
H -3.926021 -1.853776 -0.000232
H -4.480313 0.597426 -0.000212


