%chk=000299185.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299185

0 1
S -1.238288 -0.133519 1.028246
O -1.794432 0.794761 -1.418885
N -3.595241 0.108112 -0.173435
C 1.108818 -1.283578 0.326489
C 1.022234 1.180772 0.201543
C 0.422364 -0.062680 0.447453
C 2.472713 -1.245972 -0.027835
C 2.385975 1.197585 -0.172221
C 3.086656 -0.008969 -0.272475
C 0.399996 -2.575145 0.573889
C 0.228734 2.439267 0.305470
C 3.285956 -2.495594 -0.156737
C 3.096972 2.479493 -0.471459
C -2.253818 0.329918 -0.399862
C -4.120410 -0.444893 1.091490
C -4.581114 0.469303 -1.218387
H 4.139687 0.011315 -0.554825
H 0.104434 -2.672725 1.629016
H -0.517680 -2.651131 -0.030279
H 1.005511 -3.455859 0.328937
H -0.478252 2.507535 -0.543724
H -0.365913 2.482650 1.229405
H 0.842245 3.346699 0.285161
H 3.289705 -3.068284 0.781227
H 2.888488 -3.148062 -0.947474
H 4.333997 -2.290166 -0.410041
H 2.632728 2.996377 -1.324558
H 3.069747 3.163594 0.388280
H 4.153111 2.325957 -0.726529
H -5.213857 -0.572478 1.040676
H -3.901742 0.225919 1.943119
H -3.680586 -1.437660 1.304163
H -4.061587 0.871842 -2.111309
H -5.275894 1.242378 -0.852519
H -5.156056 -0.416663 -1.533311


%chk=000299185-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299185

0 1
S -1.271026 -0.172774 1.243372
O -1.705379 0.610763 -1.391814
N -3.635939 0.103648 -0.171621
C 1.143287 -1.324264 0.387477
C 1.031340 1.178067 0.288503
C 0.450881 -0.090816 0.562496
C 2.490475 -1.273827 -0.075621
C 2.374381 1.204680 -0.193064
C 3.069605 -0.013828 -0.356774
C 0.466329 -2.654802 0.676722
C 0.257418 2.470707 0.458441
C 3.316812 -2.533655 -0.288985
C 3.064663 2.514383 -0.537556
C -2.268745 0.239955 -0.332290
C -4.301923 -0.333085 1.064845
C -4.519300 0.487275 -1.290887
H 4.104214 0.017550 -0.722027
H 0.250249 -2.773498 1.755091
H -0.503830 -2.725531 0.153534
H 1.090623 -3.505287 0.362006
H -0.288458 2.709344 -0.474622
H -0.494299 2.384417 1.260894
H 0.923415 3.318707 0.689455
H 3.407699 -3.132501 0.636770
H 2.873543 -3.192084 -1.060269
H 4.337207 -2.276119 -0.620672
H 2.495007 3.090400 -1.290611
H 3.177798 3.167566 0.349369
H 4.072919 2.329603 -0.946038
H -5.141272 -1.004821 0.807092
H -4.703707 0.526393 1.636600
H -3.604758 -0.890820 1.709271
H -3.897759 0.835614 -2.128787
H -5.204783 1.299367 -0.981093
H -5.121489 -0.380630 -1.620508


