%chk=000035688.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035688

0 1
 S   -2.330200       1.008400      0.1138000    
 S    2.330100      -1.008200      0.1139000    
 S   -7.891100      0.8943000      0.1141000    
 S    7.891100     -0.8946000      0.1140000    
 O   -8.276500       1.083600      -1.463400    
 O    8.276300      -1.083900      -1.463400    
 O   -8.853300     -4.1700002E-02  0.6769000    
 O   -7.712100       2.214800      0.6971000    
 O    8.853300      4.1299999E-02  0.6769000    
 O    7.711900      -2.215100      0.6971000    
 N   -2.503200      -1.613600      0.1140000    
 N    2.503300       1.613800      0.1140000    
 N  -0.2627000     -0.6432000      0.1139000    
 N   0.2629000      0.6435000      0.1140000    
 C   -3.831200      -1.151000      0.1138000    
 C    3.831300       1.151100      0.1138000    
 C   -3.941700      0.2513000      0.1136000    
 C    3.941600     -0.2512000      0.1135000    
 C   -2.234900      -3.038700      0.1144000    
 C    2.235100       3.039000      0.1145000    
 C   -1.550800     -0.6029000      0.1140000    
 C    1.550900      0.6032000      0.1140000    
 C   -4.994300      -1.915800      0.1140000    
 C    4.994500       1.915700      0.1140000    
 C   -5.168200      0.8992000      0.1136000    
 C    5.168100     -0.8992000      0.1137000    
 C   -6.324700      0.1219000      0.1136000    
 C    6.324600     -0.1221000      0.1136000    
 C   -6.238700      -1.275900      0.1139000    
 C    6.238700       1.275700      0.1139000    
 C   -2.134300      -3.573200      -1.277400    
 C    2.134600       3.573400      -1.277400    
 H   -1.277700      -3.215500      0.6219000    
 H   -2.967200      -3.601900      0.7032000    
 H    1.278000       3.215800      0.6220000    
 H    2.967500       3.602200      0.7032000    
 H   -4.972300      -3.000500      0.1040000    
 H    4.972500       3.000300      0.1040000    
 H   -5.212000       1.983600      0.1061000    
 H    5.211700      -1.983500      0.1062000    
 H   -7.135100      -1.890500      0.1045000    
 H    7.135200       1.890300      0.1046000    
 H   -3.074000      -3.452000      -1.826300    
 H   -1.352400      -3.059500      -1.847300    
 H   -1.891100      -4.640400      -1.263100    
 H    3.074200       3.452000      -1.826300    
 H    1.352500       3.059700      -1.847300    
 H    1.891400       4.640700      -1.263200    
 H   -8.359900      0.2487000      -1.981400    
 H    8.359700     -0.2490000      -1.981500    


%chk=000035688-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035688

0 1
S -2.533301 1.237104 0.120980
S 2.533336 -1.237107 0.120963
S -8.197253 0.738316 0.027671
S 8.197289 -0.738340 0.027694
O -8.350552 0.805939 -1.827941
O 8.350702 -0.805753 -1.827911
O -9.270338 -0.335993 0.586879
O -8.176664 2.256981 0.588473
O 9.270371 0.335892 0.587063
O 8.176633 -2.257054 0.588351
N -2.596792 -1.457536 0.187328
N 2.596833 1.457534 0.187276
N -0.375819 -0.597796 0.166373
N 0.375858 0.597798 0.166341
C -3.942272 -1.072520 0.136762
C 3.942313 1.072515 0.136729
C -4.122589 0.344665 0.106640
C 4.122627 -0.344671 0.106623
C -2.137789 -2.868427 0.206297
C 2.137833 2.868427 0.206238
C -1.671816 -0.406590 0.160441
C 1.671855 0.406590 0.160384
C -5.063288 -1.937836 0.131599
C 5.063331 1.937827 0.131570
C -5.398920 0.916626 0.065461
C 5.398956 -0.916636 0.065463
C -6.485820 0.019462 0.063135
C 6.485859 -0.019475 0.063134
C -6.356806 -1.379792 0.091949
C 6.356849 1.379780 0.091933
C -2.063063 -3.482154 -1.206094
C 2.063131 3.482153 -1.206154
H -1.140733 -2.870077 0.675453
H -2.823538 -3.439338 0.857985
H 1.140769 2.870080 0.675378
H 2.823572 3.439336 0.857937
H -4.939663 -3.023511 0.151257
H 4.939709 3.023504 0.151215
H -5.563298 1.998094 0.053897
H 5.563335 -1.998104 0.053911
H -7.247676 -2.014847 0.096972
H 7.247718 2.014836 0.096960
H -3.044572 -3.465670 -1.711717
H -1.339299 -2.929580 -1.828663
H -1.727345 -4.532388 -1.139110
H 3.044647 3.465663 -1.711763
H 1.339372 2.929583 -1.828733
H 1.727419 4.532389 -1.139175
H -9.248577 1.195873 -2.040097
H 9.248867 -1.195372 -2.040057


