%chk=000155310.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155310

0 1
 S    3.261500       2.247800      1.2000001E-03
 O   -1.134900       1.633100     -9.9999997E-05
 N   0.3712000     -0.1610000     -1.1000000E-03
 N    1.665500       1.805900      1.1000000E-03
 N   -1.892700     -0.5787000     -8.9999998E-04
 C    2.836500     -0.2484000       0.000000    
 C    3.904200      0.6517000      7.9999998E-04
 C    1.602300      0.4784000      9.9999997E-05
 C    3.123300      -1.631200     -5.0000002E-04
 C    5.241900      0.2271000      6.0000003E-04
 C    4.452900      -2.065300     -5.0000002E-04
 C   -3.299200     -0.4242000     -8.9999998E-04
 C    5.496700      -1.146300     -3.9999999E-04
 C  -0.9122000      0.4267000     -1.1000000E-03
 C   -4.105100      -1.550700      1.2000001E-03
 C   -3.840700      0.8507000     -2.0000001E-03
 C   -5.491600      -1.398100      2.3000001E-03
 C   -5.227200       1.003400     -1.0000000E-03
 C   -6.052600     -0.1211000      1.1000000E-03
 H    2.324900      -2.368300     -8.9999998E-04
 H    6.060300      0.9404000      7.9999998E-04
 H   0.4061000      -1.176300     -1.9000000E-03
 H    4.670200      -3.129900     -8.9999998E-04
 H    6.524600      -1.499700     -5.0000002E-04
 H   -1.559600      -1.539500     -3.0000001E-04
 H   -3.678400      -2.549800      2.4000001E-03
 H   -3.273900       1.769300     -4.0000002E-03
 H   -6.134500      -2.273500      4.0000002E-03
 H   -5.665600       1.997200     -1.9000000E-03
 H   -7.132100     -2.2000000E-03  1.9000000E-03


%chk=000155310-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155310

0 1
S 3.479467 2.398478 0.002523
O -1.131054 1.699152 -0.001045
N 0.404988 -0.098639 0.000847
N 1.707007 1.930887 0.002429
N -1.883383 -0.540176 0.001755
C 2.882185 -0.186955 0.000098
C 4.019345 0.673026 0.000741
C 1.631385 0.589124 0.001119
C 3.076098 -1.592970 -0.001408
C 5.334573 0.160603 -0.000060
C 4.383783 -2.112209 -0.002200
C -3.298216 -0.370094 0.000780
C 5.506562 -1.238986 -0.001525
C -0.899924 0.466391 0.000466
C -4.089446 -1.551420 0.002809
C -3.933150 0.900609 -0.002126
C -5.495996 -1.467729 0.001937
C -5.343347 0.965445 -0.002972
C -6.134588 -0.205808 -0.000973
H 2.226144 -2.287835 -0.002030
H 6.201732 0.828070 0.000426
H 0.490260 -1.116078 0.000436
H 4.539771 -3.195755 -0.003373
H 6.518377 -1.658076 -0.002164
H -1.576893 -1.515445 0.003968
H -3.603129 -2.536527 0.005088
H -3.326079 1.807154 -0.003608
H -6.091230 -2.387513 0.003534
H -5.825961 1.949181 -0.005221
H -7.227482 -0.138406 -0.001650


