%chk=000293189.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293189

0 1
S 1.264334 1.475099 0.509914
O 1.451895 2.882154 0.166100
O 1.782850 0.993104 1.770376
O 3.885907 3.440311 -1.078535
O -4.619938 -1.900090 1.023969
N 2.020441 0.602302 -0.772330
N -4.489915 0.143323 -0.043782
C 2.797161 1.373324 -1.777750
C -0.390692 1.064615 0.356533
C 2.184518 -0.821178 -0.739688
C 4.063347 2.029677 -1.187979
C -0.884849 -0.126502 0.906913
C -1.264087 1.933773 -0.311999
C 2.071027 -1.552895 -1.940241
C 2.409264 -1.497525 0.473928
C -3.103953 0.415086 0.113674
C -2.230436 -0.459184 0.789615
C -2.613025 1.622997 -0.440058
C 2.176177 -2.943580 -1.914663
C 2.503158 -2.890012 0.479428
C 2.387645 -3.618761 -0.708191
C -5.183319 -1.010902 0.427421
C -6.648795 -0.996115 0.106421
H 2.141964 2.175298 -2.199648
H 3.072558 0.716219 -2.631014
H 4.926251 1.940706 -1.874949
H 4.345309 1.612419 -0.204277
H -0.209480 -0.806703 1.441466
H -0.882984 2.873888 -0.732261
H 1.890851 -1.038080 -2.881139
H 2.536358 -0.946241 1.413763
H -2.605515 -1.394878 1.222366
H -3.276722 2.309446 -0.959613
H 2.087777 -3.506820 -2.843385
H 2.677201 -3.410353 1.421800
H 2.465098 -4.702989 -0.694612
H -5.029307 0.856101 -0.543617
H 3.097978 3.647479 -0.493288
H -7.176650 -0.150112 0.568441
H -7.125311 -1.914475 0.494901
H -6.848092 -0.972426 -0.973909


%chk=000293189-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293189

0 1
S 1.538629 0.977642 1.085138
O 1.886133 2.556985 1.382451
O 1.824557 -0.118134 2.254919
O 1.737810 3.413791 -1.180910
O -5.035699 -1.519638 0.690318
N 2.787856 0.380219 -0.559913
N -4.377053 0.502633 -0.306222
C 2.288138 1.032457 -1.809927
C -0.289162 0.820901 0.635091
C 2.813597 -1.041548 -0.532550
C 2.654249 2.528460 -1.894620
C -0.985488 -0.298347 1.124661
C -0.889225 1.815413 -0.161743
C 2.150794 -1.883656 -1.480354
C 3.581755 -1.641747 0.511460
C -2.999622 0.560976 0.031709
C -2.356187 -0.430971 0.825150
C -2.257951 1.675365 -0.455160
C 2.289674 -3.281732 -1.400581
C 3.695939 -3.043095 0.593113
C 3.056672 -3.868020 -0.362416
C -5.317383 -0.486015 0.019473
C -6.727640 -0.215007 -0.496449
H 1.196463 0.903105 -1.981638
H 2.807888 0.513964 -2.641686
H 2.591862 2.839782 -2.952625
H 3.699289 2.659580 -1.546380
H -0.471585 -1.034820 1.750604
H -0.308153 2.661296 -0.549179
H 1.540883 -1.446704 -2.278011
H 4.087536 -0.990949 1.228934
H -2.933605 -1.279096 1.196077
H -2.751851 2.439007 -1.068822
H 1.794006 -3.920349 -2.140208
H 4.288073 -3.491411 1.397714
H 3.154931 -4.957482 -0.302811
H -4.726549 1.290006 -0.857092
H 1.908242 3.336144 -0.189799
H -7.408856 -0.103787 0.365191
H -7.071521 -1.091437 -1.071142
H -6.811450 0.683717 -1.131665


