%chk=000209768.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209768

0 1
O -1.298047 -2.952493 -0.347893
O -0.825747 0.105786 3.259960
O 3.557255 -2.189080 1.648603
N -1.966722 -0.754532 0.065250
N -1.907883 0.131520 1.191225
C -0.709202 -1.866704 1.785901
C 0.805119 -2.094300 1.780179
C -1.336755 -2.016784 0.404391
C -1.075894 -0.453685 2.227189
C 1.555157 -1.151798 0.838246
C -3.173987 -0.718117 -0.742873
C -1.843819 1.555751 0.909548
C 3.053347 -1.390112 0.893114
C 3.852186 -0.540527 -0.046746
C -3.130243 -1.401105 -1.972801
C -2.038679 2.422318 2.001514
C -4.323129 -0.012427 -0.352239
C -1.635841 2.062494 -0.383034
C 4.755195 0.413466 0.452955
C 3.700149 -0.725487 -1.427191
C -4.246056 -1.362686 -2.810036
C -2.029995 3.800569 1.783626
C -5.425449 0.018609 -1.209780
C -1.638467 3.445753 -0.578837
C 4.441311 0.046402 -2.329490
C 5.488341 1.192775 -0.460111
C -5.391685 -0.652067 -2.436078
C -1.834642 4.315981 0.497614
C 4.931423 0.608425 1.921704
C 5.335232 1.012173 -1.832265
C 4.297323 -0.148879 -3.803432
H -1.183008 -2.610373 2.481775
H 1.199045 -1.982079 2.815594
H 1.015479 -3.150179 1.497605
H 1.196203 -1.267524 -0.206387
H 1.357394 -0.088051 1.092481
H -2.242436 -1.968049 -2.261162
H -2.180210 2.022172 3.008196
H -4.364025 0.508508 0.604649
H -1.477682 1.394055 -1.229415
H 3.010886 -1.482548 -1.799971
H -4.220587 -1.892704 -3.762280
H -2.177571 4.477639 2.625230
H -6.318877 0.568819 -0.914498
H -1.482933 3.845578 -1.580820
H 6.187216 1.941155 -0.088862
H -6.255626 -0.624208 -3.097114
H -1.833727 5.392175 0.336410
H 5.914493 1.620080 -2.526294
H 5.817835 1.206569 2.168730
H 4.064624 1.116229 2.368111
H 5.046781 -0.357857 2.443867
H 4.076467 0.797551 -4.316704
H 5.224647 -0.548381 -4.240484
H 3.493819 -0.850017 -4.063870


%chk=000209768-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209768

0 1
O -1.400767 -3.157044 0.468275
O -0.845121 0.870191 3.114721
O 3.490763 -1.945626 2.073817
N -2.075327 -0.889809 0.280112
N -1.912214 0.311056 1.071579
C -0.787264 -1.457726 2.197505
C 0.753455 -1.654723 2.278908
C -1.408678 -1.978414 0.900930
C -1.179483 0.018911 2.254657
C 1.508644 -0.848366 1.206653
C -3.190543 -1.014664 -0.622591
C -1.925828 1.601480 0.431439
C 3.024039 -1.119697 1.230953
C 3.897142 -0.397373 0.246965
C -3.110947 -1.959116 -1.676951
C -2.198165 2.749360 1.216751
C -4.357618 -0.229867 -0.446165
C -1.635479 1.727186 -0.951025
C 5.306594 -0.660764 0.151994
C 3.311399 0.577509 -0.614908
C -4.212098 -2.118754 -2.545218
C -2.165560 4.023923 0.611065
C -5.442658 -0.392217 -1.332757
C -1.622692 3.007778 -1.542897
C 4.057096 1.305152 -1.564820
C 6.046223 0.074286 -0.810760
C -5.378484 -1.336277 -2.383525
C -1.883782 4.161298 -0.767589
C 6.043639 -1.670043 1.010804
C 5.447343 1.034358 -1.649870
C 3.402760 2.339085 -2.464386
H -1.247601 -2.012249 3.037487
H 1.095529 -1.352353 3.283425
H 0.970415 -2.731318 2.170203
H 1.125564 -1.091484 0.194162
H 1.337066 0.236015 1.358425
H -2.213728 -2.570099 -1.794838
H -2.411011 2.642043 2.282410
H -4.418808 0.491035 0.373677
H -1.427997 0.838951 -1.554454
H 2.239125 0.784968 -0.539980
H -4.152149 -2.855671 -3.353339
H -2.368657 4.910396 1.221408
H -6.342088 0.217862 -1.195994
H -1.407685 3.101821 -2.613047
H 7.122492 -0.116291 -0.896970
H -6.225571 -1.459670 -3.066517
H -1.871232 5.152757 -1.232488
H 6.062981 1.579674 -2.376267
H 7.108395 -1.711689 0.720666
H 5.971731 -1.418818 2.083352
H 5.605814 -2.679583 0.922729
H 3.889933 3.326718 -2.362553
H 3.475767 2.049179 -3.529783
H 2.333330 2.466510 -2.222384


