%chk=000072772.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072772

0 1
 S  -0.4371000      -1.774000     -4.9999999E-03
 N   0.1057000       1.285000     -3.8999999E-03
 N    2.459300       1.081300     -1.1000000E-03
 N   -2.180600       1.885100      1.9999999E-04
 N   -3.924000      0.2313000      3.5000001E-03
 N   -3.407600      -2.059000      1.9000000E-03
 C    1.245600      0.4689000     -2.6000000E-03
 C    1.128600     -0.9252000     -1.8000000E-03
 C   -1.602000     -0.4401000     -2.0000001E-03
 C   -1.243100      0.9049000     -2.2000000E-03
 C    2.299800      -1.691500      1.5000000E-03
 C    3.566700      0.3072000      1.7000000E-03
 C   -2.962900     -0.7127000      8.9999998E-04
 C    3.541400      -1.071700      3.4000000E-03
 C    4.878500       1.018000      2.4999999E-03
 C   -3.468300       1.492500      3.0000000E-03
 H   0.2806000       2.282600     -4.1000000E-03
 H    2.257100      -2.778400      2.3000001E-03
 H    4.451500      -1.661200      5.7000001E-03
 H    5.456300      0.7519000     -0.8884000    
 H    4.737800       2.103900      1.4000000E-03
 H    5.454500      0.7535000      0.8949000    
 H   -4.213200       2.278600      4.9000001E-03
 H   -3.149900      -2.571700     -0.8370000    
 H   -3.147200      -2.571300      0.8402000    


%chk=000072772-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072772

0 1
S -0.402805 -1.864004 0.703141
N 0.146039 1.236981 0.472043
N 2.451592 1.068612 0.131850
N -2.077383 1.871815 0.089556
N -3.842824 0.227337 -0.245815
N -3.410760 -2.075604 -0.172928
C 1.270654 0.413151 0.299321
C 1.171717 -1.005693 0.277644
C -1.570557 -0.508992 0.257121
C -1.180525 0.848570 0.279873
C 2.338089 -1.745105 0.015167
C 3.597421 0.346923 -0.073355
C -2.927717 -0.792106 -0.060854
C 3.568568 -1.067252 -0.158349
C 4.884589 1.132032 -0.211790
C -3.365977 1.492782 -0.136840
H 0.324094 2.246024 0.467578
H 2.295686 -2.838124 -0.033486
H 4.489374 -1.627384 -0.345724
H 5.362548 0.947884 -1.191884
H 4.675608 2.208718 -0.119864
H 5.614378 0.845189 0.567893
H -4.095685 2.299801 -0.252276
H -2.791726 -2.882505 -0.141172
H -4.396898 -2.191151 -0.396953


