%chk=000218607.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218607

0 1
S 3.619249 0.086060 -1.327302
F 4.641220 0.843635 1.000289
F 3.052870 2.079315 0.327838
F 4.957157 2.194740 -0.611787
O -5.309165 -0.622407 -0.749760
O -3.679392 -2.118122 -0.473572
N -1.208967 -1.154750 0.151869
C -1.819320 0.097559 0.237966
C 0.197352 -1.401581 0.188373
C -3.210919 0.218116 -0.051379
C 1.116698 -0.570602 -0.478132
C 0.646501 -2.556094 0.867552
C -1.099721 1.255419 0.642048
C 2.469818 -0.901390 -0.422285
C -3.824551 1.490168 0.030301
C 2.006352 -2.859740 0.893512
C 2.935625 -2.027765 0.253588
C -1.734460 2.482598 0.713362
C -3.102411 2.611494 0.397972
C -4.010088 -0.942337 -0.424111
C 4.075609 1.338175 -0.100771
H -1.816474 -1.990997 0.022715
H 0.772113 0.303212 -1.037335
H -0.067934 -3.204685 1.376656
H -0.050955 1.174397 0.925921
H -4.892051 1.567753 -0.204924
H 2.352426 -3.749522 1.422225
H 3.999954 -2.265802 0.289245
H -1.171925 3.366616 1.023701
H -3.580720 3.586297 0.452599
H -5.836591 -1.431760 -0.997872


%chk=000218607-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218607

0 1
S 3.816819 0.105655 -1.241057
F 4.357201 0.919971 1.339647
F 2.747226 2.122676 0.313224
F 4.914589 2.363946 -0.325006
O -5.333230 -0.718970 -0.533081
O -3.557374 -2.156504 -0.192297
N -1.151214 -1.086527 0.204354
C -1.767040 0.166947 0.218997
C 0.224097 -1.405836 0.177801
C -3.193645 0.255851 -0.013035
C 1.205479 -0.574269 -0.428905
C 0.629333 -2.660912 0.717316
C -1.059652 1.374674 0.506929
C 2.554798 -0.977157 -0.417763
C -3.836281 1.526849 0.003818
C 1.979785 -3.057442 0.681608
C 2.969570 -2.208836 0.130450
C -1.724446 2.610579 0.524760
C -3.116425 2.702365 0.257933
C -3.986719 -0.957859 -0.243169
C 3.958822 1.416969 0.080430
H -1.825361 -1.874851 0.158058
H 0.919035 0.350272 -0.934302
H -0.124093 -3.314335 1.171652
H 0.002933 1.339480 0.757268
H -4.913318 1.558375 -0.181250
H 2.270976 -4.024179 1.105136
H 4.025572 -2.491494 0.131807
H -1.152324 3.514860 0.760659
H -3.621451 3.672685 0.267347
H -5.786362 -1.594983 -0.660828


