%chk=000090123.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090123

0 1
 S   -3.287600      -1.979600     -0.7869000    
 P    1.881200      -1.014100      0.5046000    
 P   -3.884900      1.2000001E-03 -0.4372000    
 O    3.268700     -0.9120000     -0.3397000    
 O    1.538200      0.5479000      0.8055000    
 O    2.059800      -1.791700       1.784000    
 O   -5.397200      5.3399999E-02  0.1569000    
 O   -2.997500      0.6097000      0.7820000    
 O   -3.755500      0.8174000      -1.697300    
 N   0.7424000      -1.590200     -0.5532000    
 C  -0.6408000      -1.686300     -0.1142000    
 C   -1.555600      -1.858700      -1.320300    
 C    4.434400     -0.4424000      0.3162000    
 C    1.513900       1.494400     -0.2499000    
 C    5.588300     -0.4387000     -0.6747000    
 C    1.168100       2.860400      0.3227000    
 C    6.879600      4.0700000E-02 -3.6300000E-02
 C    1.108900       3.926500     -0.7565000    
 C   -5.719100     -0.6539000       1.342100    
 C   -2.945100       2.015900      0.9523000    
 H  -0.7403000      -2.529300      0.5792000    
 H  -0.9004000     -0.7743000      0.4306000    
 H   0.9888000      -2.436300      -1.066200    
 H   -1.456600      -1.019900      -2.017300    
 H   -1.306200      -2.776800      -1.862800    
 H    4.658900      -1.104600       1.159000    
 H    4.256800      0.5656000      0.7042000    
 H   0.7626000       1.191500     -0.9864000    
 H    2.490400       1.526800     -0.7420000    
 H    5.335900      0.2001000      -1.529700    
 H    5.726700      -1.447200      -1.082600    
 H    1.909900       3.139000       1.080800    
 H   0.2070000       2.807500      0.8474000    
 H    7.691200      3.4000002E-02 -0.7705000    
 H    7.169600     -0.6077000      0.7966000    
 H    6.773600       1.061800      0.3437000    
 H   0.8605000       4.897600     -0.3171000    
 H   0.3451000       3.686300      -1.503100    
 H    2.072100       4.021200      -1.267800    
 H   -6.707300     -0.3333000       1.681100    
 H   -4.990300     -0.4413000       2.128100    
 H   -5.747200      -1.727100       1.139100    
 H   -2.414200       2.237100       1.881300    
 H   -3.957000       2.425200       1.011200    
 H   -2.406400       2.469400      0.1164000    


%chk=000090123-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090123

0 1
S -3.380769 -1.158791 -1.270376
P 1.553295 -0.471835 0.455104
P -3.399857 0.570063 0.251932
O 3.158150 -0.627904 -0.183885
O 1.085613 1.189426 0.256698
O 1.316354 -0.862514 1.977463
O -5.030885 0.595901 0.822567
O -2.465357 -0.141866 1.533838
O -2.901091 1.994981 -0.243198
N 0.772864 -1.407156 -0.762828
C -0.648419 -1.783116 -0.653350
C -1.520309 -1.015693 -1.671813
C 4.305054 -0.296672 0.710049
C 1.208404 1.861364 -1.068712
C 5.561369 -0.867213 0.049860
C 0.319739 3.107401 -1.019877
C 6.825673 -0.544134 0.878296
C 0.391811 3.896426 -2.347320
C -5.587051 -0.612808 1.478445
C -1.649140 0.742665 2.425321
H -0.763294 -2.873695 -0.794706
H -1.000728 -1.555699 0.368979
H 1.369107 -1.858617 -1.457808
H -1.265328 0.056669 -1.689179
H -1.430855 -1.414802 -2.696424
H 4.129728 -0.742161 1.708411
H 4.371743 0.804217 0.814444
H 0.884590 1.166873 -1.871286
H 2.271719 2.122703 -1.235026
H 5.654526 -0.446448 -0.968802
H 5.443004 -1.961120 -0.059307
H 0.652332 3.746429 -0.180385
H -0.722813 2.806319 -0.808262
H 7.726177 -0.960605 0.393595
H 6.761350 -0.973622 1.895365
H 6.972640 0.547401 0.980378
H -0.250550 4.792822 -2.295878
H 0.040219 3.284717 -3.199628
H 1.423145 4.230663 -2.570040
H -6.571573 -0.291874 1.849264
H -4.942856 -0.938418 2.313450
H -5.705093 -1.434329 0.748870
H -0.818597 0.106003 2.765525
H -2.275353 1.086065 3.266349
H -1.245289 1.597184 1.857185


