%chk=000287405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287405

0 1
S 0.516708 -2.309300 0.244157
O 0.942414 -2.997026 1.431210
O 1.210622 -2.502733 -0.991102
O -3.214000 -1.649671 -0.252811
O -1.709214 2.252084 -1.035702
N -1.165784 -2.687844 -0.024916
N -1.925140 0.767478 0.676792
C 0.174136 -0.599129 0.627846
C -1.178916 -0.269168 -0.041574
C -2.017567 -1.575422 -0.122143
C 1.338533 0.269163 0.244257
C 2.539977 0.113445 0.962015
C 1.263977 1.220470 -0.779775
C -2.178040 2.011681 0.062042
C 3.652117 0.891538 0.639103
C 2.383035 1.998512 -1.096153
C 3.577984 1.835311 -0.392410
C -3.018454 2.952553 0.867885
H 0.048058 -0.489863 1.743548
H -1.002622 0.089821 -1.109822
H -1.561203 -3.628977 -0.120737
H -2.340321 0.513238 1.566424
H 2.615531 -0.612483 1.771994
H 0.330685 1.378627 -1.334466
H 4.582161 0.761816 1.192057
H 2.314866 2.734775 -1.897518
H 4.448874 2.438131 -0.643902
H -3.124691 3.913126 0.333158
H -4.036014 2.567503 1.030380
H -2.581811 3.180643 1.849664


%chk=000287405-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287405

0 1
S 0.558712 -2.471354 -0.153589
O 1.343437 -3.491805 0.834220
O 0.898548 -2.465519 -1.736686
O -3.281233 -1.621409 0.609202
O -1.625079 2.195275 -1.100422
N -1.303484 -2.765830 0.109501
N -1.912566 0.787754 0.727943
C 0.207214 -0.531484 0.637262
C -1.225193 -0.330176 0.088611
C -2.058263 -1.630033 0.294867
C 1.331382 0.355636 0.281977
C 2.481950 0.347697 1.126162
C 1.332060 1.171336 -0.885282
C -2.125995 1.985361 0.045212
C 3.605081 1.134669 0.813116
C 2.458842 1.961114 -1.190143
C 3.596381 1.943586 -0.349789
C -2.981189 3.012043 0.771071
H 0.210697 -0.855476 1.692315
H -1.182136 -0.106780 -0.996462
H -1.704295 -3.708927 0.153094
H -2.497752 0.567982 1.538274
H 2.491106 -0.284093 2.022917
H 0.446668 1.227481 -1.524915
H 4.484269 1.118901 1.465525
H 2.448109 2.592886 -2.084186
H 4.469980 2.556920 -0.596609
H -2.379527 3.919500 0.952289
H -3.822869 3.302112 0.119790
H -3.378954 2.650934 1.734236


