%chk=000195219.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195219

0 1
S -5.723526 0.100919 1.071423
N -3.105362 0.690293 0.696753
N -4.074609 -1.147113 -0.578140
C 4.746908 0.158236 -0.439490
C 3.269655 0.080890 -0.034465
C 5.619525 -0.727773 0.459521
C 2.392073 0.967204 -0.933133
C 7.099235 -0.652763 0.057454
C 0.948071 0.880341 -0.523410
C 0.426704 1.764703 0.434255
C 0.106048 -0.091339 -1.083568
C 7.972047 -1.532844 0.949475
C -1.746462 0.706016 0.248219
C -0.908690 1.687343 0.823092
C -1.234346 -0.185739 -0.707788
C -4.101286 -0.176527 0.278307
C -6.474030 -1.268226 0.130655
C -5.356186 -1.851760 -0.758642
H 5.097995 1.206919 -0.388593
H 4.864721 -0.147816 -1.496952
H 2.914675 -0.967065 -0.085225
H 3.147529 0.386151 1.022993
H 5.502741 -0.424075 1.517616
H 5.270295 -1.777123 0.409348
H 2.744736 2.017434 -0.889445
H 2.511606 0.665982 -1.993682
H 7.217797 -0.959368 -1.000260
H 7.450703 0.396296 0.109231
H 1.071260 2.520732 0.881572
H 0.499332 -0.787880 -1.824230
H 9.025795 -1.473300 0.655303
H 7.907385 -1.231524 2.001186
H 7.674504 -2.586111 0.892380
H -1.292537 2.382708 1.565201
H -1.867721 -0.952535 -1.162234
H -3.359641 1.390629 1.396803
H -7.317790 -0.880956 -0.466599
H -6.875772 -2.017486 0.834801
H -5.188945 -2.930202 -0.532093
H -5.631942 -1.790368 -1.836838


%chk=000195219-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195219

0 1
S -5.855475 0.144945 1.145176
N -3.166211 0.671517 0.702063
N -4.136117 -1.125879 -0.575314
C 4.795162 0.143345 -0.431479
C 3.304489 0.071615 -0.032558
C 5.707966 -0.727904 0.460723
C 2.395278 0.949973 -0.937389
C 7.200206 -0.656068 0.062371
C 0.927592 0.883674 -0.544555
C 0.387631 1.769655 0.423973
C 0.058599 -0.090468 -1.096931
C 8.106253 -1.528278 0.958330
C -1.814060 0.699409 0.257527
C -0.959640 1.684395 0.822889
C -1.294986 -0.195775 -0.713643
C -4.187834 -0.168050 0.300127
C -6.575927 -1.270345 0.117888
C -5.406889 -1.837494 -0.785468
H 5.136914 1.199036 -0.385632
H 4.907496 -0.172685 -1.490192
H 2.954125 -0.979284 -0.079678
H 3.183887 0.391897 1.022312
H 5.596719 -0.412716 1.519426
H 5.368055 -1.783675 0.414416
H 2.755267 1.996944 -0.886578
H 2.522013 0.620101 -1.987672
H 7.309609 -0.971616 -0.995471
H 7.538609 0.399360 0.108166
H 1.029407 2.540710 0.868095
H 0.446699 -0.785161 -1.852814
H 9.166462 -1.460789 0.651894
H 8.038973 -1.211866 2.016517
H 7.806631 -2.592251 0.908102
H -1.353164 2.386289 1.570496
H -1.957537 -0.946521 -1.149361
H -3.410629 1.367760 1.407698
H -7.400026 -0.863765 -0.487118
H -6.961883 -2.030744 0.813113
H -5.253788 -2.910903 -0.566234
H -5.687382 -1.755487 -1.852412


