%chk=000226070.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226070

0 1
S -4.211945 1.402121 0.108760
O 3.721796 -0.507153 0.689419
O 2.603618 1.443916 0.908109
O -1.067668 -2.463974 -0.089724
N -1.641583 1.516529 -0.597690
N -2.482324 -0.656025 -0.016731
C 2.348322 0.047061 -1.126764
C 1.893053 1.275306 -1.931557
C 1.204583 -0.974006 -0.978807
C 0.697942 1.974177 -1.268426
C -0.126699 -0.349484 -0.699667
C -0.354070 0.985992 -0.858223
C 2.847590 0.461016 0.248568
C -1.199622 -1.272816 -0.255404
C -2.648392 0.625402 -0.177950
C 4.274312 -0.343886 2.023133
C -5.243344 0.058534 0.712830
H 3.198763 -0.451444 -1.664014
H 1.620451 0.949604 -2.956139
H 2.727973 1.994672 -2.043344
H 1.445759 -1.714676 -0.180249
H 1.126850 -1.578101 -1.910703
H 0.295516 2.752809 -1.945192
H 1.057785 2.508487 -0.349098
H -1.810939 2.516872 -0.681839
H 3.500104 -0.596752 2.754269
H 4.625622 0.683143 2.166942
H 5.097115 -1.066272 2.033735
H -4.951143 -0.253428 1.726114
H -5.166819 -0.837794 0.073223
H -6.286008 0.399668 0.723124


%chk=000226070-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226070

0 1
S -4.169835 1.481141 0.360237
O 3.429488 -0.660176 0.807519
O 3.008121 1.617647 0.636212
O -1.018556 -2.518996 -0.232395
N -1.596415 1.506693 -0.512212
N -2.428548 -0.654184 0.035947
C 2.380309 0.082361 -1.226929
C 1.905117 1.332955 -2.004534
C 1.237561 -0.967309 -1.118190
C 0.698685 2.015503 -1.319473
C -0.098862 -0.351863 -0.762672
C -0.332009 1.005377 -0.865544
C 2.942913 0.464590 0.145347
C -1.177557 -1.265446 -0.312120
C -2.587655 0.640524 -0.069557
C 4.007563 -0.424746 2.154052
C -5.187004 -0.020361 0.861524
H 3.217969 -0.395064 -1.772531
H 1.623070 1.012986 -3.025463
H 2.727083 2.064392 -2.095944
H 1.488058 -1.744425 -0.375674
H 1.141951 -1.503322 -2.083310
H 0.234413 2.741421 -2.016484
H 1.062426 2.585120 -0.442580
H -1.779892 2.510840 -0.579597
H 3.251541 0.024615 2.819114
H 4.876311 0.250877 2.081936
H 4.305553 -1.421274 2.507413
H -5.492343 0.100851 1.910057
H -4.516509 -0.890210 0.739302
H -6.056346 -0.091019 0.193257


