%chk=000148475.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148475

0 1
 S   -7.649700      0.4284000      2.7999999E-03
 N    1.236500     -0.3919000      1.9999999E-04
 N   -3.689300     -0.4527000     -3.8999999E-03
 N    7.451600      0.3544000      1.2200000E-02
 C   -1.212200     -0.4231000     -2.6000000E-03
 C   4.6200000E-02  0.4466000      1.2100000E-02
 C    2.446200      0.4221000      5.5999998E-03
 C    3.687300     -0.4703000     -1.8300001E-02
 C   -2.504400      0.3966000     -8.0000004E-03
 C    4.969000      0.3691000     -3.8999999E-03
 C    6.248800     -0.4695000      1.0000000E-03
 C   -4.904200      0.3499000     -1.9800000E-02
 C   -6.125800     -0.5596000      2.2700001E-02
 H   -1.195600      -1.074100     -0.8870000    
 H   -1.207600      -1.082700      0.8757000    
 H   3.7500001E-02   1.101100     -0.8678000    
 H   3.5599999E-02   1.082900      0.9054000    
 H    2.460200       1.078600     -0.8729000    
 H    2.471300       1.056300      0.9002000    
 H    3.683300      -1.139400      0.8513000    
 H    3.676300      -1.103500     -0.9142000    
 H   -2.511100       1.053300      0.8709000    
 H   -2.509500       1.036400     -0.8990000    
 H    1.232900      -1.010200      0.8109000    
 H    4.961500       1.018400      0.8812000    
 H    4.974400       1.030500     -0.8799000    
 H   -3.679200      -1.051300      0.8215000    
 H    6.256700      -1.125000      0.8790000    
 H    6.270300      -1.111700     -0.8862000    
 H   -4.916300       1.026600      0.8442000    
 H   -4.929500      0.9606000     -0.9311000    
 H   -6.141100      -1.233800     -0.8404000    
 H   -6.126900      -1.172500      0.9305000    
 H    7.458000      0.9397000      0.8465000    
 H    8.272500     -0.2459000      7.7200003E-02
 H   -8.502000     -0.6060000      4.5800000E-02


%chk=000148475-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148475

0 1
S -7.826781 0.202026 -0.044770
N 1.244340 -0.246794 0.092912
N -3.730028 -0.372157 0.131876
N 7.551026 0.169690 -0.066897
C -1.243185 -0.306409 0.104064
C 0.018136 0.578646 0.072505
C 2.509752 0.517213 0.033796
C 3.729251 -0.424651 0.040851
C -2.546138 0.515762 0.086407
C 5.072038 0.335836 -0.019344
C 6.294056 -0.604792 -0.009572
C -5.035042 0.320679 0.098354
C -6.156851 -0.710821 -0.102551
H -1.229917 -0.994629 -0.759737
H -1.222208 -0.937752 1.019928
H 0.025317 1.173929 -0.862889
H -0.023171 1.315913 0.916982
H 2.507936 1.107135 -0.904794
H 2.610119 1.255854 0.871992
H 3.701769 -1.053157 0.957478
H 3.642983 -1.117080 -0.819025
H -2.530024 1.256346 0.927015
H -2.597788 1.102938 -0.852146
H 1.241456 -0.897623 0.892498
H 5.141406 1.032474 0.843944
H 5.122110 0.959013 -0.932989
H -3.671502 -1.028133 0.924494
H 6.216952 -1.280039 0.879960
H 6.252796 -1.254958 -0.904963
H -5.242032 0.927607 1.015217
H -5.029960 1.022988 -0.756430
H -6.041722 -1.207052 -1.078416
H -6.145593 -1.467949 0.700970
H 7.675235 0.812062 0.722712
H 8.390690 -0.392510 -0.236019
H -8.603727 -0.881305 -0.421513


