%chk=000070057.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070057

0 1
 S   -2.188100      -2.501400      3.0000001E-04
 N  -0.6780000       1.697500      6.9999998E-04
 C    1.063900      8.6900003E-02  3.0000001E-04
 C  -0.2442000     -0.5865000      5.0000002E-04
 C   -1.241900      0.5169000      8.9999998E-04
 C   0.7137000       1.455300      3.9999999E-04
 C    2.415200     -0.3148000       0.000000    
 C   -2.683800      0.2711000      3.9999999E-04
 C    3.397800      0.7153000     -6.0000003E-04
 C    1.675500       2.449000       0.000000    
 C   -3.191700      -1.031900      1.9999999E-04
 C  -0.5816000      -1.877000     -3.0000001E-04
 C    3.015200       2.072100     -3.9999999E-04
 C    2.871600      -1.652600      6.0000003E-04
 C    4.762300      0.3830000     -6.9999998E-04
 C   -3.552700       1.372100      1.9999999E-04
 C   -4.584600      -1.210300     -6.0000003E-04
 C    4.234200      -1.961800      3.0000001E-04
 C    5.178500     -0.9455000     -6.0000003E-04
 C   -4.932500       1.176800     -6.0000003E-04
 C   -5.448800     -0.1141000     -8.9999998E-04
 H    1.399500       3.498200       0.000000    
 H   0.1794000      -2.642900     -1.1000000E-03
 H    3.771500       2.855500     -6.0000003E-04
 H    2.183500      -2.488200      1.5000000E-03
 H   -3.174800       2.391100      5.0000002E-04
 H    5.521200       1.163400     -1.0000000E-03
 H   -5.018700      -2.208500     -1.0000000E-03
 H    4.553300      -3.000100      6.0000003E-04
 H    6.237700      -1.184400     -7.9999998E-04
 H   -5.602700       2.031200     -7.9999998E-04
 H   -6.523500     -0.2704000     -1.6000000E-03


%chk=000070057-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070057

0 1
S -2.232816 -2.554035 -0.000521
N -0.684815 1.724547 -0.000295
C 1.059210 0.107327 -0.000143
C -0.232440 -0.589250 -0.000230
C -1.250718 0.501427 -0.000203
C 0.719584 1.496302 -0.000220
C 2.434669 -0.306018 -0.000026
C -2.687081 0.273789 -0.000218
C 3.444027 0.744700 -0.000090
C 1.712748 2.514357 -0.000261
C -3.250495 -1.038453 -0.000314
C -0.564736 -1.924805 -0.000398
C 3.053421 2.131113 -0.000203
C 2.882519 -1.667948 0.000171
C 4.830557 0.384562 -0.000023
C -3.588083 1.382749 -0.000115
C -4.653892 -1.237282 -0.000291
C 4.244369 -1.986386 0.000234
C 5.231609 -0.953635 0.000111
C -4.976047 1.190610 -0.000098
C -5.514785 -0.125482 -0.000179
H 1.408628 3.565033 -0.000326
H 0.164910 -2.736638 -0.000516
H 3.843566 2.891513 -0.000259
H 2.153283 -2.482914 0.000325
H -3.143256 2.382704 -0.000049
H 5.579527 1.185877 -0.000088
H -5.064124 -2.253192 -0.000352
H 4.558303 -3.036318 0.000400
H 6.295411 -1.214347 0.000139
H -5.647781 2.055413 -0.000016
H -6.598872 -0.280321 -0.000147


