%chk=000161356.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161356

0 1
 S    2.302500      0.3915000       2.124200    
 P    2.385200     -1.5000000E-02  0.2204000    
 O    1.132900     -0.8176000     -0.4037000    
 O    3.623400     -0.9450000     -0.2779000    
 O    2.503200       1.252500     -0.7931000    
 O   -2.192100       2.464300      0.1457000    
 N   -2.866200      0.2209000      3.7300002E-02
 C   -2.484200      -1.120300     -9.8999999E-02
 C  -0.1775000     -0.4178000     -0.2547000    
 C   -1.186200      -1.440300     -0.2408000    
 C   -1.927200       1.267600      3.1199999E-02
 C  -0.4983000      0.8741000     -0.1280000    
 C   -3.534700      -2.196100     -8.6300001E-02
 C   -4.280400      0.5581000      0.1899000    
 C    3.687900      -2.304100      0.1204000    
 C    3.511700       2.227200     -0.5858000    
 H  -0.8648000      -2.471400     -0.3480000    
 H   0.2142000       1.687000     -0.1412000    
 H   -4.083300      -2.194400      0.8610000    
 H   -3.097700      -3.194400     -0.2018000    
 H   -4.243100      -2.059400     -0.9096000    
 H   -4.426800       1.637600      0.2856000    
 H   -4.672900      8.1500001E-02   1.093200    
 H   -4.832800      0.2180000     -0.6911000    
 H    3.753800      -2.376900       1.208600    
 H    4.582200      -2.753200     -0.3185000    
 H    2.808700      -2.845500     -0.2376000    
 H    3.217900       2.897400      0.2256000    
 H    3.625500       2.811000      -1.502500    
 H    4.465500       1.747400     -0.3505000    


%chk=000161356-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161356

0 1
S 2.497307 0.177311 2.225743
P 2.445334 -0.113718 0.190128
O 1.042404 -0.885714 -0.504128
O 3.650259 -1.127903 -0.503912
O 2.567247 1.252807 -0.845863
O -2.411186 2.514795 0.064694
N -2.972555 0.217982 0.003003
C -2.605465 -1.119800 -0.112301
C -0.283612 -0.430644 -0.305417
C -1.266137 -1.466369 -0.263640
C -2.008122 1.311963 -0.037021
C -0.626525 0.908030 -0.203353
C -3.688807 -2.172606 -0.058589
C -4.389105 0.609840 0.172098
C 4.025346 -2.377319 0.198679
C 3.590942 2.282889 -0.539146
H -0.965631 -2.511115 -0.346480
H 0.113901 1.708081 -0.268508
H -4.239695 -2.145305 0.900121
H -3.243146 -3.173325 -0.167786
H -4.431889 -2.038183 -0.866727
H -4.404774 1.709047 0.236813
H -4.810898 0.181586 1.097966
H -4.996200 0.284641 -0.690538
H 4.196283 -2.187957 1.274494
H 4.957676 -2.699054 -0.287779
H 3.238304 -3.138829 0.062484
H 3.542720 2.578978 0.524704
H 3.326843 3.131884 -1.185854
H 4.595578 1.902707 -0.790885


