%chk=000264716.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264716

0 1
S 3.533843 -0.788368 0.943875
O -2.828585 2.115997 -0.015708
O -2.971371 0.903545 -1.959027
N -0.488831 2.042025 0.075696
N -4.539145 0.656612 -0.218520
N 0.789913 0.895899 1.613235
N 0.866626 1.530596 -1.976126
N 2.813436 0.139712 -1.469668
C -4.485738 -1.854386 0.010049
C -5.111063 -0.636711 -0.681740
C -4.918837 -1.997922 1.474496
C 0.563966 1.456261 -0.642808
C 1.363518 0.750130 0.337610
C -1.633800 2.773062 -0.481441
C 2.510258 0.089254 -0.153651
C -0.299618 1.648541 1.445614
C -4.303213 -3.236352 2.120551
C 4.858856 -1.454805 -0.115838
C 5.784278 -2.234496 0.809573
C -3.400893 1.136380 -0.854860
C 1.989251 0.852310 -2.319814
C 6.944799 -2.845298 0.024313
H -4.765970 -2.768509 -0.552787
H -3.379638 -1.806839 -0.056545
H -4.972785 -0.713588 -1.787964
H -6.208913 -0.589510 -0.497560
H -6.023693 -2.054150 1.538215
H -4.625527 -1.098323 2.049684
H -1.725828 3.782569 -0.022935
H -1.586633 2.791339 -1.598313
H -0.994927 1.958927 2.215859
H -4.658949 0.871853 0.772946
H -4.601518 -4.156103 1.604157
H -4.614219 -3.334163 3.167220
H -3.206987 -3.197444 2.109530
H 5.384792 -0.630447 -0.635322
H 4.428135 -2.093223 -0.911444
H 6.186874 -1.575746 1.607851
H 5.228254 -3.041724 1.331481
H 2.283563 0.866099 -3.382538
H 7.614095 -3.407820 0.685774
H 7.547045 -2.076180 -0.473685
H 6.591578 -3.537104 -0.749537


%chk=000264716-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264716

0 1
S 3.787777 -0.708987 1.126322
O -2.792993 2.116824 -0.021571
O -2.794738 0.617646 -1.862824
N -0.390126 1.946459 0.112013
N -4.430007 0.539573 -0.168646
N 0.948067 0.970730 1.708696
N 0.911527 1.361499 -1.917277
N 2.923291 0.066047 -1.377432
C -4.896699 -1.937626 0.005525
C -5.199442 -0.598247 -0.705204
C -5.287947 -1.960008 1.500786
C 0.674055 1.352631 -0.579984
C 1.494181 0.754197 0.427637
C -1.515664 2.661874 -0.489225
C 2.661127 0.090288 -0.037151
C -0.165265 1.685218 1.477003
C -5.014947 -3.328011 2.162699
C 5.108646 -1.364685 -0.074830
C 6.196627 -2.090473 0.734001
C -3.309827 1.016606 -0.792992
C 2.055445 0.690978 -2.236799
C 7.306806 -2.633140 -0.195494
H -5.450144 -2.737210 -0.527962
H -3.819206 -2.168548 -0.105143
H -4.949422 -0.675841 -1.777192
H -6.277513 -0.359645 -0.621943
H -6.363862 -1.706387 1.602512
H -4.722821 -1.175849 2.044892
H -1.534098 3.712705 -0.162452
H -1.415575 2.569418 -1.584525
H -0.856833 2.025752 2.244410
H -4.698345 0.970997 0.716202
H -5.584958 -4.131811 1.659929
H -5.302499 -3.325362 3.229838
H -3.942035 -3.588954 2.102085
H 5.505423 -0.499230 -0.629141
H 4.600916 -2.031499 -0.789638
H 6.638461 -1.397216 1.475692
H 5.746638 -2.926344 1.303770
H 2.315431 0.645721 -3.297895
H 8.086396 -3.154704 0.388513
H 7.793606 -1.813602 -0.756177
H 6.896944 -3.349882 -0.931133


