%chk=000189427.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189427

0 1
S -0.397604 -4.209598 -0.208265
N -0.199823 0.334007 -0.020853
C 2.227878 0.378176 0.108141
C 0.955742 -0.380982 0.009523
C 2.728944 1.109646 -0.988170
C -1.384394 -0.346169 -0.093097
C 0.979521 -1.792830 -0.037570
C -2.621231 0.472425 -0.107884
C -0.236298 -2.463954 -0.125944
C -1.440348 -1.751187 -0.156222
C 2.931785 0.351714 1.320638
C 3.945930 1.796364 -0.847464
C 1.981708 1.157048 -2.279315
C 4.138597 1.042404 1.447773
C 4.644230 1.763200 0.361049
C -3.738669 0.069284 0.641696
C -2.678480 1.652719 -0.866301
C -4.906522 0.835242 0.618375
C -3.851427 2.411937 -0.887482
C -4.966149 2.003885 -0.148378
C 1.277566 -4.870657 -0.149419
H 1.933622 -2.310942 -0.008243
H -2.400543 -2.258973 -0.236430
H 2.528936 -0.203931 2.167241
H 4.344952 2.364070 -1.685862
H 1.001595 1.644464 -2.138559
H 2.511721 1.712113 -3.062263
H 1.781230 0.149009 -2.669261
H 4.680382 1.022961 2.390643
H 5.584960 2.303423 0.458051
H -3.693258 -0.833168 1.250071
H -1.801215 1.978207 -1.427362
H -5.771224 0.522259 1.201065
H -3.893996 3.325818 -1.477732
H -5.878532 2.597353 -0.165973
H 1.196380 -5.966586 -0.201999
H 1.793821 -4.615803 0.783621
H 1.887513 -4.537351 -0.997339


%chk=000189427-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189427

0 1
S -0.410433 -4.359532 0.505950
N -0.183655 0.249133 -0.138184
C 2.270401 0.285078 -0.092998
C 0.976032 -0.464944 -0.032200
C 2.521331 1.306595 -1.064714
C -1.384366 -0.414403 -0.049960
C 0.984972 -1.876112 0.154431
C -2.615213 0.423092 -0.172514
C -0.247352 -2.557232 0.257367
C -1.448802 -1.814492 0.163074
C 3.279337 -0.040642 0.854094
C 3.780906 1.958763 -1.039031
C 1.511048 1.693532 -2.130430
C 4.522178 0.625523 0.866783
C 4.774226 1.634531 -0.088587
C -3.889986 -0.143189 -0.446720
C -2.517690 1.833043 -0.018960
C -5.034065 0.675718 -0.554967
C -3.661333 2.650780 -0.124630
C -4.926719 2.076515 -0.391468
C 1.378043 -4.925056 0.582377
H 1.941599 -2.402426 0.190254
H -2.413478 -2.318147 0.271782
H 3.068044 -0.804062 1.612067
H 3.983924 2.735402 -1.786264
H 0.648031 2.217556 -1.686049
H 1.976297 2.347260 -2.888852
H 1.096245 0.806185 -2.641836
H 5.278142 0.366489 1.616117
H 5.733724 2.163937 -0.095716
H -3.995848 -1.222474 -0.601991
H -1.531026 2.259603 0.184956
H -6.007385 0.222305 -0.773644
H -3.567918 3.735155 0.003030
H -5.816213 2.711021 -0.474695
H 1.330155 -6.013361 0.740107
H 1.899798 -4.452635 1.428953
H 1.894351 -4.712911 -0.366433


