%chk=000202183.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202183

0 1
O 4.270638 0.692732 -0.015216
O 3.445609 -0.883479 1.381974
N 0.873801 -2.764797 -2.362146
C -0.547051 -0.033629 -0.335329
C -0.505143 -0.881424 -1.634962
C 0.770790 -0.189527 0.472893
C -0.201184 -2.379981 -1.392437
C -1.760987 -0.512531 0.468839
C -0.702688 1.460937 -0.639027
C 2.023728 0.138887 -0.341082
C -1.470617 -3.234584 -1.519685
C -1.639847 -1.316877 1.609233
C -0.390442 2.004861 -1.891988
C -3.048982 -0.164924 0.019794
C -1.128596 2.324549 0.386580
C 3.262159 -0.113080 0.467731
C -2.778878 -1.759976 2.291211
C -0.514130 3.379349 -2.121872
C -4.183430 -0.607994 0.699946
C -1.250676 3.695482 0.156502
C 1.592682 -4.008867 -1.971316
C -4.052504 -1.408569 1.840573
C -0.945330 4.228628 -1.100814
C 5.585313 0.611146 0.617062
C 5.574122 1.370231 1.928204
H 0.268272 -0.458621 -2.314552
H -1.461179 -0.766129 -2.178757
H 0.728587 0.452930 1.375208
H 0.855970 -1.236231 0.846976
H 0.212105 -2.513548 -0.355237
H 2.068805 -0.499653 -1.260139
H 2.002201 1.187506 -0.710535
H -1.917889 -3.173462 -2.516104
H -1.268414 -4.289681 -1.310775
H -2.234006 -2.903184 -0.801995
H 0.475320 -2.886424 -3.299494
H -0.658056 -1.612400 1.980500
H -0.041507 1.362819 -2.701333
H -3.162780 0.463975 -0.863538
H -1.372356 1.921280 1.369978
H -2.666845 -2.382061 3.177914
H -0.269961 3.785997 -3.101881
H -5.173388 -0.328569 0.343164
H -1.584125 4.351918 0.958685
H 0.959614 -4.904599 -1.889907
H 2.382196 -4.208057 -2.714205
H 2.094860 -3.854899 -1.001065
H -4.937080 -1.752516 2.371513
H -1.041437 5.297065 -1.279609
H 5.848187 -0.453763 0.745803
H 6.218673 1.083957 -0.155316
H 5.173608 2.384209 1.802214
H 4.942280 0.862427 2.672749
H 6.580788 1.455953 2.352173


%chk=000202183-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202183

0 1
O 4.400937 0.382266 -0.106561
O 3.266239 -0.116562 1.870588
N 0.986571 -2.813768 -1.664335
C -0.573465 -0.106083 -0.318861
C -0.583820 -0.878958 -1.686060
C 0.761645 -0.363656 0.455451
C -0.451841 -2.424853 -1.586216
C -1.795508 -0.603578 0.505529
C -0.721017 1.426138 -0.535255
C 2.021355 0.149459 -0.261210
C -1.336742 -3.119455 -2.657807
C -1.675690 -1.375405 1.688877
C -0.610428 2.054741 -1.801622
C -3.105468 -0.298171 0.043383
C -0.940087 2.256555 0.598425
C 3.243160 0.113994 0.638389
C -2.822461 -1.829358 2.383843
C -0.714049 3.460514 -1.932481
C -4.250831 -0.751288 0.729129
C -1.039194 3.657126 0.474982
C 1.310575 -4.179840 -1.204060
C -4.115328 -1.524027 1.907269
C -0.925789 4.269927 -0.795976
C 5.686426 0.429879 0.654495
C 5.914134 1.821998 1.251572
H 0.238776 -0.511227 -2.330099
H -1.526947 -0.633296 -2.210526
H 0.702305 0.107907 1.453917
H 0.888051 -1.449575 0.610387
H -0.806987 -2.751564 -0.589086
H 2.238105 -0.470167 -1.149846
H 1.894158 1.191331 -0.614909
H -1.085526 -2.750595 -3.671953
H -1.196801 -4.216259 -2.646282
H -2.408174 -2.913882 -2.477180
H 1.360064 -2.632003 -2.607979
H -0.688154 -1.622227 2.089898
H -0.447409 1.457460 -2.703879
H -3.225642 0.321262 -0.853983
H -1.048992 1.793779 1.586508
H -2.700695 -2.420552 3.298945
H -0.626878 3.919462 -2.924274
H -5.247870 -0.496412 0.351540
H -1.209223 4.270857 1.367029
H 0.792318 -5.002239 -1.752677
H 2.398911 -4.347977 -1.291827
H 1.045411 -4.275517 -0.134618
H -5.002905 -1.874873 2.445738
H -1.004625 5.358289 -0.896280
H 5.658008 -0.343083 1.442884
H 6.446528 0.175478 -0.101856
H 5.884163 2.596616 0.465801
H 5.146236 2.051258 2.009217
H 6.905269 1.862956 1.741005


