%chk=000210670.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210670

0 1
S 3.755261 1.185201 2.425023
O 1.578125 3.739961 -1.412320
O -5.430506 1.188332 -0.657027
N -0.357703 -1.034540 0.040938
N 0.756573 -0.238844 0.105741
N 3.233741 1.841347 -0.075143
C 1.376521 -2.430217 0.355887
C -0.015429 -2.388211 0.182507
C 2.139434 -3.690014 0.530182
C -0.906999 -3.574088 0.141423
C 1.185696 -4.864266 0.828583
C -0.057980 -4.844128 -0.074549
C 1.824592 -1.070720 0.304033
C 3.228865 -0.596169 0.433712
C 3.349179 0.850905 0.839136
C -1.650510 -0.430729 -0.143739
C 3.263940 3.284617 0.298347
C 2.840699 1.637945 -1.498207
C 1.900813 3.918354 -0.015833
C 1.509712 2.353546 -1.792708
C -2.794751 -1.016015 0.437667
C -1.755927 0.758337 -0.886400
C -4.041122 -0.440822 0.233944
C -3.003082 1.349162 -1.089505
C -4.136733 0.739716 -0.535304
C -5.656129 2.415718 -1.393253
H 2.728051 -3.900476 -0.387065
H 2.876656 -3.587226 1.353460
H -1.469732 -3.656757 1.096676
H -1.664992 -3.482726 -0.663453
H 1.724104 -5.821772 0.705148
H 0.872760 -4.819888 1.890471
H -0.678055 -5.739269 0.116603
H 0.254408 -4.901527 -1.135721
H 3.786237 -0.804433 -0.508401
H 3.741211 -1.228483 1.208672
H 4.072599 3.777772 -0.287196
H 3.518289 3.426586 1.378401
H 2.748214 0.558590 -1.744900
H 3.649745 2.058290 -2.140171
H 1.092396 3.487972 0.603365
H 1.918568 5.017844 0.085628
H 1.307031 2.412128 -2.876669
H 0.655223 1.871467 -1.265888
H -2.706274 -1.906607 1.061039
H -0.850567 1.233695 -1.290504
H -4.944115 -0.872018 0.663782
H -3.075458 2.268469 -1.663370
H -5.349568 2.295679 -2.436052
H -5.143371 3.250931 -0.907344
H -6.746240 2.524782 -1.313645


%chk=000210670-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210670

0 1
S 5.039473 -0.528297 0.422448
O 2.115646 3.823575 0.974456
O -5.864807 0.936865 -1.232881
N -0.565540 -0.955365 -0.575427
N 0.473823 -0.300504 -1.256334
N 3.451700 1.581702 -0.292217
C 1.302028 -2.096111 -0.052850
C -0.086601 -2.049953 0.151385
C 2.193187 -3.161107 0.542030
C -0.877950 -3.054252 0.949098
C 1.426602 -3.953116 1.634068
C -0.006421 -4.320883 1.173664
C 1.602005 -1.000385 -0.924792
C 2.949875 -0.563675 -1.460689
C 3.771053 0.256810 -0.450973
C -1.904841 -0.482365 -0.754615
C 4.173928 2.460039 0.663947
C 2.358038 2.308913 -0.992959
C 3.176831 3.071088 1.666127
C 1.400852 2.935982 0.044237
C -2.877336 -0.614311 0.271025
C -2.256597 0.156372 -1.966299
C -4.183925 -0.136781 0.072379
C -3.563369 0.647413 -2.165831
C -4.536093 0.495653 -1.145582
C -6.273595 1.613325 -2.466291
H 2.526787 -3.858266 -0.254840
H 3.114130 -2.708323 0.954951
H -1.159261 -2.635895 1.937871
H -1.823072 -3.319505 0.437428
H 1.987924 -4.870700 1.891375
H 1.363951 -3.343051 2.557611
H -0.496586 -4.968397 1.924914
H 0.051117 -4.899933 0.230735
H 2.804081 -0.002342 -2.402557
H 3.556017 -1.452649 -1.693287
H 4.669223 3.267595 0.090118
H 4.939962 1.853301 1.177258
H 1.775058 1.633212 -1.633487
H 2.814497 3.111133 -1.606555
H 2.727407 2.266517 2.286416
H 3.680926 3.801924 2.319105
H 0.652943 3.570152 -0.458506
H 0.882945 2.127471 0.601412
H -2.614258 -1.061964 1.232641
H -1.495219 0.265923 -2.742612
H -4.943030 -0.228373 0.854731
H -3.808248 1.135651 -3.113552
H -6.178214 0.944223 -3.343605
H -5.682780 2.534659 -2.635479
H -7.330864 1.874405 -2.313212


