%chk=000126729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126729

1 1
 S   -5.018000      -2.109600     -7.4600004E-02
 N    3.844500     -0.4390000     -9.1000004E-03
 N   -4.020800      0.4770000      3.4299999E-02
 C    2.332500     -0.6016000     -6.8000004E-02
 C    1.651700      0.7613000     -1.9000000E-03
 C    4.505100      -1.808300     -7.9300001E-02
 C    4.309400      0.4094000      -1.184000    
 C    4.231000      0.2444000       1.294600    
 C   0.1449000      0.6848000      7.8999996E-03
 C  -0.5444000      0.7045000      -1.194500    
 C  -0.5239000      0.5970000       1.219000    
 C   -1.937500      0.6347000      -1.185700    
 C   -1.917000      0.5271000       1.227800    
 C   -2.623900      0.5459000      2.5500000E-02
 C   -4.433600     -0.6278000     -1.2000000E-02
 H    2.034100      -1.239500      0.7730000    
 H    2.087600      -1.125600      -1.000100    
 H    1.941500       1.324100      0.8914000    
 H    1.933200       1.392300     -0.8523000    
 H    4.214800      -2.283900      -1.020900    
 H    5.590500      -1.676500     -3.8199998E-02
 H    4.160900      -2.401700      0.7729000    
 H    4.016200       1.451500      -1.036600    
 H    5.402200      0.3573000      -1.225800    
 H    3.881600      6.9999998E-04  -2.104100    
 H    3.967400       1.304100       1.260200    
 H    3.730700     -0.2663000       2.122600    
 H    5.316900      0.1620000       1.409000    
 H  -1.9200001E-02  0.7713000      -2.143000    
 H   1.7600000E-02  0.5796000       2.160500    
 H   -2.477700      0.6521000      -2.128900    
 H   -2.441100      0.4601000       2.177900    


%chk=000126729-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126729

1 1
S -6.720923 -0.813199 -0.079354
N 3.984406 -0.329067 -0.002448
N -3.950847 -0.226812 -0.035797
C 2.426673 -0.405843 -0.006362
C 1.676855 0.942271 0.051158
C 4.523445 -1.759155 -0.071791
C 4.489536 0.450416 -1.214225
C 4.489136 0.329953 1.279191
C 0.176327 0.654017 0.030134
C -0.524198 0.562858 -1.200031
C -0.536830 0.440011 1.237659
C -1.900040 0.269985 -1.232255
C -1.912786 0.145814 1.225729
C -2.608117 0.055414 -0.014599
C -5.134982 -0.477877 -0.054627
H 2.153246 -1.031739 0.861397
H 2.154383 -0.953066 -0.926187
H 1.933562 1.496421 0.971920
H 1.942114 1.576014 -0.814106
H 4.165008 -2.234487 -0.997482
H 5.623964 -1.732501 -0.067890
H 4.160565 -2.324043 0.800271
H 4.167686 1.498352 -1.138949
H 5.589398 0.403803 -1.235058
H 4.079308 -0.003403 -2.129288
H 4.164635 1.379458 1.306804
H 4.080922 -0.212370 2.145673
H 5.589108 0.283865 1.294276
H 0.000184 0.744047 -2.146630
H -0.022548 0.524715 2.203156
H -2.439776 0.213645 -2.182005
H -2.462213 -0.006099 2.159313


