%chk=000036229.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036229

0 1
 S   -1.890100       1.384400     -6.0000003E-04
 N   -1.413100      -1.150300     -6.9999998E-04
 N    3.506900     -0.9864000      3.9999999E-04
 C  -0.1825000     -0.5100000     -3.9999999E-04
 C  -0.2391000      0.8871000     -1.9999999E-04
 C    1.082500      -1.136900     -3.0000001E-04
 C   0.9223000       1.676200      1.9999999E-04
 C    2.242800     -0.3574000      1.9999999E-04
 C   -2.374100     -0.2561000     -6.9999998E-04
 C    2.161400       1.030800      3.9999999E-04
 C   -3.817000     -0.5815000      1.7000000E-03
 H    1.143800      -2.222100     -5.0000002E-04
 H   0.8663000       2.760500      3.9999999E-04
 H    3.066000       1.635200      7.9999998E-04
 H   -4.309400     -0.1789000      0.8928000    
 H   -4.313000     -0.1763000     -0.8863000    
 H   -3.966200      -1.666200      3.9999999E-04
 H    3.569700      -1.995700      8.9999998E-04
 H    4.350100     -0.4280000      1.4000000E-03


%chk=000036229-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036229

0 1
S -1.941761 1.530233 0.000478
N -1.417717 -1.116709 0.000614
N 3.525040 -1.012950 0.000180
C -0.161578 -0.467357 0.000483
C -0.217034 0.963699 0.000415
C 1.079620 -1.137013 0.000401
C 0.968158 1.723130 0.000267
C 2.279491 -0.378803 0.000257
C -2.425959 -0.273809 0.000726
C 2.206414 1.051667 0.000189
C -3.878555 -0.644470 0.001132
H 1.093978 -2.231638 0.000457
H 0.943562 2.817114 0.000199
H 3.134543 1.635688 0.000066
H -4.395014 -0.245741 0.893251
H -4.396273 -0.243086 -0.889046
H -3.967190 -1.742350 -0.000376
H 3.592742 -2.025865 0.000162
H 4.384833 -0.473340 0.000045


