%chk=000208265.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208265

0 1
S 0.266537 -2.436281 -1.806593
S -4.600069 -0.267392 1.565857
O -5.803768 -1.010000 1.107735
N 1.825123 3.221879 0.370823
N 0.469465 -0.339401 0.375880
C 1.730041 1.795563 -0.089723
C 0.612135 1.104635 0.762844
C 1.473284 1.658884 -1.606394
C 0.295103 2.512006 -2.087424
C 0.700403 4.064022 -0.138025
C 0.458572 3.973102 -1.653913
C 0.853185 1.252668 2.266846
C 3.151952 3.811133 0.020317
C -0.843096 -0.839340 0.128712
C 1.597011 -1.202714 0.259695
C -1.066532 -1.844616 -0.837761
C 1.603008 -2.245169 -0.691927
C -1.949820 -0.345065 0.853155
C 2.726760 -1.056311 1.092103
C -2.339078 -2.352396 -1.081513
C -3.218896 -0.845313 0.575646
C 2.681088 -3.119641 -0.808117
C 3.814766 -1.918029 0.956060
C -3.433430 -1.838394 -0.373832
C 3.800783 -2.949691 0.011614
C -4.715799 1.405705 0.868395
H 2.710048 1.302728 0.143766
H -0.360941 1.608317 0.503798
H 1.300325 0.597117 -1.873071
H 2.391578 1.951360 -2.151235
H -0.654536 2.100472 -1.693892
H 0.213996 2.449209 -3.189411
H 0.885833 5.117837 0.158984
H -0.213655 3.743989 0.410004
H 1.301571 4.436400 -2.200551
H -0.437894 4.557762 -1.928924
H 0.084022 0.745514 2.857103
H 1.825820 0.838969 2.573947
H 0.866577 2.315695 2.549644
H 3.358552 3.872869 -1.058354
H 3.948380 3.215019 0.493470
H 3.214385 4.826924 0.442388
H -1.803405 0.404736 1.628120
H 2.746582 -0.276411 1.858559
H -2.491068 -3.141053 -1.821167
H 2.657978 -3.931127 -1.538161
H 4.683067 -1.789163 1.602874
H -4.443911 -2.217719 -0.559368
H 4.651604 -3.619994 -0.081183
H -3.820668 1.986359 1.095751
H -5.583066 1.920932 1.295391
H -4.855601 1.404314 -0.217642


%chk=000208265-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208265

0 1
S 0.224775 -2.416003 -1.948510
S -4.672965 -0.249776 1.756273
O -5.942264 -1.221051 1.257280
N 1.882404 3.238230 0.329548
N 0.497261 -0.324033 0.275496
C 1.764581 1.824809 -0.136041
C 0.651754 1.103460 0.701474
C 1.534889 1.720054 -1.674509
C 0.366856 2.614940 -2.158337
C 0.774795 4.109675 -0.147277
C 0.562611 4.075723 -1.685225
C 0.827437 1.324342 2.229607
C 3.226156 3.820339 0.133646
C -0.825860 -0.836007 0.124871
C 1.612892 -1.217866 0.192871
C -1.109733 -1.868186 -0.817403
C 1.614280 -2.281059 -0.754104
C -1.906987 -0.341990 0.910098
C 2.739615 -1.105227 1.053075
C -2.403513 -2.407734 -0.957556
C -3.196760 -0.859461 0.704850
C 2.683206 -3.194711 -0.838011
C 3.831292 -1.992688 0.942504
C -3.478501 -1.894339 -0.195982
C 3.811379 -3.043820 -0.000287
C -4.957958 1.393406 0.780785
H 2.728110 1.336160 0.102878
H -0.311695 1.563724 0.414608
H 1.361736 0.667789 -1.964270
H 2.465689 2.043982 -2.182623
H -0.597703 2.225246 -1.772035
H 0.296322 2.570790 -3.261627
H 0.980424 5.139934 0.198544
H -0.165788 3.791128 0.348885
H 1.442917 4.516823 -2.194774
H -0.313340 4.697445 -1.955525
H 0.316349 0.532354 2.806713
H 1.889168 1.347581 2.527341
H 0.410287 2.303654 2.518247
H 3.539043 3.938870 -0.932087
H 3.978428 3.184038 0.634020
H 3.261693 4.819253 0.605773
H -1.724398 0.414853 1.679441
H 2.756412 -0.333702 1.824162
H -2.573142 -3.215755 -1.676830
H 2.635663 -4.011272 -1.566249
H 4.689373 -1.870604 1.612468
H -4.505543 -2.271494 -0.274027
H 4.650936 -3.741716 -0.078961
H -4.073373 2.039219 0.889870
H -5.854815 1.851639 1.222660
H -5.130096 1.099934 -0.264437


