%chk=000288544.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288544

0 1
S 1.340894 -1.233477 1.288097
N 1.372536 -0.332847 -1.240038
C 0.382633 -0.848577 -0.257719
C -0.714592 0.117508 0.088083
C -2.089839 -0.256092 -0.111161
C 2.653601 -0.090044 -0.668287
C 2.832503 -0.574695 0.650376
C -3.108996 0.675108 0.223235
C -0.407596 1.362108 0.595922
C -2.477059 -1.532017 -0.634971
C -2.752506 1.958002 0.746012
C 3.723793 0.504011 -1.346569
C -1.433706 2.290070 0.926074
C 4.054263 -0.495427 1.293110
C -4.482500 0.316078 0.031986
C -3.799158 -1.852094 -0.809037
C 4.960603 0.582996 -0.691854
C 5.129618 0.093360 0.606185
C -4.818666 -0.914842 -0.470484
H -0.013591 -1.820654 -0.662831
H 1.013660 0.400707 -1.855281
H 0.630175 1.655732 0.768135
H -1.694132 -2.249923 -0.893250
H -3.546354 2.660020 0.998642
H 3.607896 0.878080 -2.358981
H -1.149632 3.262024 1.328006
H 4.186646 -0.874832 2.305311
H -5.251442 1.041292 0.295525
H -4.091314 -2.823460 -1.206207
H 5.805716 1.036392 -1.210462
H 6.099739 0.165810 1.092166
H -5.860193 -1.196117 -0.617935


%chk=000288544-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288544

0 1
S 1.135348 -1.184002 1.067736
N 1.532033 0.598114 -0.924674
C 0.407817 -0.230881 -0.476746
C -0.844106 0.547876 -0.127521
C -2.130371 -0.114263 -0.115131
C 2.820232 0.205713 -0.533539
C 2.835069 -0.743116 0.528592
C -3.316105 0.669467 0.178980
C -0.761930 1.911990 0.180499
C -2.291602 -1.520549 -0.361801
C -3.186108 2.067527 0.468604
C 4.040299 0.687173 -1.058711
C -1.930381 2.675440 0.477770
C 4.039271 -1.203071 1.079184
C -4.599968 0.030101 0.185228
C -3.555636 -2.115991 -0.344314
C 5.258971 0.221012 -0.505628
C 5.266088 -0.714280 0.552821
C -4.723029 -1.335359 -0.075535
H 0.180265 -1.029409 -1.210068
H 1.387421 1.218172 -1.720938
H 0.223523 2.388806 0.197854
H -1.413807 -2.148640 -0.545450
H -4.088875 2.649004 0.690570
H 4.043424 1.410975 -1.881673
H -1.833270 3.740830 0.712547
H 4.038392 -1.929009 1.898793
H -5.487263 0.635543 0.405853
H -3.655175 -3.190832 -0.531189
H 6.206472 0.591222 -0.912649
H 6.213804 -1.070512 0.969249
H -5.707802 -1.814850 -0.066911


