%chk=000064035.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064035

0 1
 S   -1.020500      -2.690000     -0.4422000    
 O   7.9499997E-02   2.212200      0.4475000    
 N  -0.4519000     -2.6799999E-02 -4.7699999E-02
 N    1.326100      -1.579400     -0.4191000    
 C    1.859900      0.7491000      0.1076000    
 C   0.4163000       1.055300      0.2058000    
 C    2.251900     -0.5487000     -0.2244000    
 C   -1.859400      0.2624000     -5.0299998E-02
 C   6.3699998E-02  -1.306300     -0.3200000    
 C    2.814700       1.750800      0.3198000    
 C    3.617200     -0.8351000     -0.3418000    
 C   -2.479400      0.6367000      -1.235000    
 C   -2.580900      0.1638000       1.132000    
 C    4.171200       1.451700      0.1998000    
 C    4.572700      0.1600000     -0.1320000    
 C   -3.845700      0.9174000      -1.237400    
 C   -3.947200      0.4445000       1.129600    
 C   -4.579600      0.8213000     -5.5199999E-02
 C  -0.4085000      -3.638800      0.9628000    
 H    2.523200       2.765700      0.5754000    
 H    3.945300      -1.840400     -0.5952000    
 H   -1.915400      0.7142000      -2.160500    
 H   -2.096300     -0.1289000       2.059500    
 H    4.914700       2.226300      0.3635000    
 H    5.629200     -7.3700003E-02 -0.2255000    
 H   -4.338200       1.210700      -2.159900    
 H   -4.518700      0.3696000       2.050200    
 H   -5.643500       1.039900     -5.7200000E-02
 H  -0.4396000      -3.036000       1.874700    
 H   0.6164000      -3.976600      0.7874000    
 H   -1.041100      -4.518800       1.107200    


%chk=000064035-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064035

0 1
S -1.292419 -2.538555 0.243989
O -0.019166 2.383231 -0.000545
N -0.479299 0.079383 0.108683
N 1.271997 -1.575564 0.210348
C 1.855160 0.830488 0.092559
C 0.428239 1.205266 0.062127
C 2.231102 -0.549645 0.163270
C -1.910282 0.362832 0.069465
C -0.001665 -1.241557 0.182748
C 2.851059 1.840579 0.048577
C 3.611493 -0.892286 0.186742
C -2.569337 0.426700 -1.177161
C -2.609641 0.583642 1.275489
C 4.210643 1.488936 0.072692
C 4.587130 0.117348 0.141464
C -3.952995 0.704976 -1.214443
C -3.993306 0.861602 1.231081
C -4.665755 0.920620 -0.011887
C -0.174891 -4.049096 0.343657
H 2.525921 2.884828 -0.004852
H 3.880843 -1.951422 0.240378
H -2.002306 0.265554 -2.099623
H -2.073667 0.542191 2.229104
H 4.981055 2.266183 0.038428
H 5.648722 -0.153440 0.159509
H -4.471218 0.756834 -2.177846
H -4.542819 1.034752 2.162450
H -5.738960 1.138485 -0.043450
H 0.448218 -3.987019 1.245925
H 0.463685 -4.094592 -0.548717
H -0.861438 -4.909155 0.389238


