%chk=000181743.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181743

0 1
O -0.256065 -2.772354 -0.070519
O -3.145915 -3.144134 -0.257702
O 4.872749 0.726031 0.108752
O 4.207215 -1.331498 -0.870923
N -2.041132 3.152253 0.212251
C -1.009840 2.123645 -0.165535
C -1.563276 0.709328 -0.156634
C 0.157531 2.188269 0.850391
C -2.944482 0.455674 -0.166605
C -0.636559 -0.357966 -0.133282
C -3.320108 2.920001 -0.535475
C -3.926867 1.586787 -0.080138
C 1.210533 1.199215 0.443183
C 0.807236 -0.043456 -0.089633
C -1.124213 -1.679812 -0.115233
C -3.421012 -0.857217 -0.216379
C -1.539818 4.532733 -0.068736
C 2.575609 1.549898 0.571986
C -2.513601 -1.928071 -0.199390
C 1.763314 -0.964287 -0.590996
C 3.488682 0.628408 0.110617
C 3.085514 -0.606265 -0.473252
C 5.363212 -0.506649 -0.519306
C 0.237831 -3.050130 1.271388
C -2.350745 -4.334263 -0.494799
H -0.602159 2.316664 -1.197874
H -0.221063 1.956533 1.870446
H 0.560337 3.217420 0.914900
H -3.185431 2.920830 -1.639005
H -4.020812 3.748465 -0.293018
H -4.840016 1.371851 -0.669442
H -4.257210 1.674064 0.981069
H -4.486750 -1.073917 -0.257832
H -2.278438 5.260243 0.305196
H -1.342446 4.748589 -1.129081
H -0.609060 4.704610 0.497751
H 2.883373 2.497095 1.003806
H 1.451359 -1.910625 -1.041911
H 5.953366 -1.051175 0.228938
H 5.876420 -0.227411 -1.448698
H -0.596006 -3.306876 1.929321
H 0.793329 -2.189417 1.656090
H 0.900760 -3.904764 1.101857
H -3.117243 -5.059846 -0.790253
H -1.852520 -4.624639 0.433581
H -1.619084 -4.166433 -1.292471


%chk=000181743-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181743

0 1
O -0.131187 -2.793837 0.205095
O -2.929584 -3.288027 0.198954
O 5.020336 0.888951 0.052695
O 4.392138 -1.292856 -0.726557
N -2.035013 3.155992 0.125313
C -0.981129 2.141080 -0.140907
C -1.510545 0.703078 -0.056595
C 0.204078 2.264555 0.844931
C -2.898558 0.428236 -0.027723
C -0.547922 -0.361630 0.002299
C -3.282387 2.848874 -0.616832
C -3.908296 1.563384 -0.060747
C 1.290802 1.281715 0.446698
C 0.905095 -0.023785 0.003727
C -1.030513 -1.700319 0.096863
C -3.347881 -0.911467 0.028231
C -1.573494 4.534799 -0.144295
C 2.655882 1.671894 0.491725
C -2.427238 -1.969856 0.081428
C 1.907718 -0.950518 -0.429539
C 3.610184 0.742139 0.075856
C 3.235251 -0.536143 -0.382168
C 5.518299 -0.330667 -0.643258
C -0.097913 -3.403341 1.555728
C -2.584019 -4.196213 -0.918745
H -0.565893 2.287871 -1.178352
H -0.177593 2.058445 1.865464
H 0.614741 3.288090 0.846009
H -3.093550 2.737909 -1.716273
H -3.980403 3.695910 -0.486559
H -4.788196 1.273939 -0.666913
H -4.270249 1.765147 0.966421
H -4.417190 -1.148319 0.031317
H -2.408078 5.235109 0.033965
H -1.215339 4.680505 -1.195410
H -0.754924 4.817336 0.538018
H 2.945268 2.669363 0.833546
H 1.633274 -1.948253 -0.769705
H 6.329457 -0.775355 -0.046136
H 5.836090 -0.051802 -1.666135
H -1.100483 -3.776659 1.832434
H 0.254200 -2.662285 2.297458
H 0.618713 -4.236295 1.487637
H -3.019377 -5.170468 -0.647915
H -1.489097 -4.278425 -1.034343
H -3.038976 -3.830401 -1.859301


