%chk=000088520.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088520

0 1
 S   -2.482500      -1.276000       1.482100    
 S    1.984400      -1.112700      -1.131000    
 S  -0.7866000      -2.196300     -0.8073000    
 P   -3.731600     -0.3401000      7.6600000E-02
 P    3.668100     -0.6201000      2.0300001E-02
 O   -2.911900      0.7201000     -0.8377000    
 O    3.351600      0.6970000      0.9135000    
 O   -4.450700      -1.360200     -0.7660000    
 O    4.134800      -1.796100      0.8350000    
 C   -4.905300      0.6851000      0.9643000    
 C    4.940800     -4.3400001E-02  -1.102600    
 C   -5.832200       1.439300      3.4600001E-02
 C    6.194000      0.3984000     -0.3770000    
 C   -1.755400      -2.702200      0.6372000    
 C   0.7309000      -1.687600      4.2300001E-02
 C   -2.179100       1.778600     -0.2484000    
 C    2.886300       1.875100      0.2796000    
 C   -1.525400       2.595100      -1.342800    
 C    2.669700       2.946100       1.327200    
 H   -5.503400      3.7099998E-02   1.614700    
 H   -4.381700       1.388000       1.619500    
 H    4.570900      0.7646000      -1.740300    
 H    5.197600     -0.8710000      -1.773800    
 H   -5.271900       2.116300     -0.6166000    
 H   -6.387800      0.7468000     -0.6051000    
 H   -6.552000       2.031500      0.6075000    
 H    5.985700       1.240400      0.2896000    
 H    6.597600     -0.4162000      0.2322000    
 H    6.962800      0.7078000      -1.091300    
 H   -2.566700      -3.352700      0.2990000    
 H   -1.137100      -3.276200       1.333200    
 H   0.5184000     -0.8721000      0.7383000    
 H    1.140500      -2.534600      0.5992000    
 H   -1.412700       1.370000      0.4164000    
 H   -2.846100       2.420000      0.3328000    
 H    1.942900       1.675800     -0.2358000    
 H    3.619800       2.233100     -0.4460000    
 H  -0.8574000       1.968600      -1.943200    
 H   -2.280000       3.001200      -2.024400    
 H  -0.9476000       3.422400     -0.9212000    
 H    1.941500       2.612800       2.074000    
 H    3.601700       3.156200       1.862400    
 H    2.308000       3.871900      0.8710000    


%chk=000088520-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088520

0 1
S -2.106765 -2.052784 0.403190
S 2.937995 -1.888477 -1.089657
S -0.006690 -1.532128 -1.965816
P -3.338413 -0.095165 0.055069
P 3.015141 0.028893 0.244036
O -2.552129 1.149408 0.959336
O 3.304605 1.345461 -0.846597
O -3.536885 0.140801 -1.519184
O 1.710312 0.131619 1.170994
C -4.887495 -0.280680 1.089252
C 4.673640 -0.015773 1.109222
C -5.759998 0.990261 1.049644
C 4.930235 1.266380 1.926621
C -1.631079 -2.297082 -1.410422
C 1.155783 -2.335616 -0.709842
C -1.185712 1.612095 0.561386
C 2.248060 1.733404 -1.827301
C -0.860300 2.797786 1.464099
C 2.800737 2.924355 -2.603170
H -5.417746 -1.158379 0.681118
H -4.552909 -0.520927 2.112644
H 5.432933 -0.164139 0.322639
H 4.653842 -0.915613 1.748016
H -5.221308 1.853760 1.474045
H -6.056816 1.239286 0.015940
H -6.678370 0.825946 1.641223
H 4.959531 2.154356 1.273567
H 4.146460 1.419338 2.688797
H 5.901678 1.182794 2.445653
H -2.402095 -1.810278 -2.034837
H -1.614497 -3.385510 -1.570762
H 0.896555 -1.963394 0.295988
H 1.088681 -3.432959 -0.767992
H -1.209430 1.898080 -0.507825
H -0.464452 0.787773 0.709914
H 1.322421 1.989767 -1.278601
H 2.042443 0.867549 -2.485290
H -1.571753 3.627378 1.310225
H -0.890465 2.493240 2.523929
H 0.161893 3.155930 1.241998
H 3.009837 3.771142 -1.927394
H 3.733828 2.651609 -3.124677
H 2.061599 3.252295 -3.357180


