%chk=000215120.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215120

0 1
O -6.819949 -1.838523 -0.136882
O -1.786425 3.250426 0.696950
O 4.342659 -4.323906 0.123186
N -4.439839 -0.271396 0.032135
N -0.972961 1.235799 0.015551
N -0.068103 0.203559 0.021882
C -3.187697 0.248258 0.667128
C -4.372667 -1.757038 -0.161517
C -5.654281 0.087517 0.834392
C -2.325070 0.816927 -0.480766
C -5.647414 -2.210834 -0.890248
C -6.898695 -0.414980 0.084522
C 0.445386 2.738883 1.440721
C -0.852959 2.471452 0.704586
C 1.606610 2.790948 0.497339
C 1.986121 1.633874 -0.208379
C 1.227316 0.368211 -0.072969
C 2.019189 -0.890101 -0.059132
C 2.317771 3.987204 0.315702
C 3.082556 1.690546 -1.087163
C 3.403622 4.030669 -0.558822
C 3.786687 2.881078 -1.261227
C 3.161838 -0.981432 0.763137
C 1.633060 -1.987315 -0.840992
C 3.912061 -2.147544 0.797358
C 2.376783 -3.171172 -0.825996
C 3.508441 -3.238651 -0.004731
C 4.029037 -5.515925 -0.637968
H -2.620948 -0.524375 1.229154
H -3.409182 1.060271 1.393552
H -3.478398 -1.989652 -0.777901
H -4.268059 -2.314556 0.794300
H -5.637362 -0.335334 1.861503
H -5.694891 1.194511 0.928878
H -2.815959 1.716146 -0.923379
H -2.204188 0.069560 -1.294530
H -5.734229 -3.309946 -0.936879
H -5.717968 -1.774499 -1.902196
H -7.021592 0.092649 -0.888562
H -7.817454 -0.319352 0.688438
H 0.610085 1.964760 2.223832
H 0.329674 3.694773 2.002199
H 2.017032 4.885681 0.853652
H 3.377914 0.795751 -1.638590
H 3.953214 4.961315 -0.697861
H 4.632592 2.918506 -1.946043
H 3.456491 -0.127458 1.375836
H 0.740833 -1.918867 -1.467425
H 4.795897 -2.243224 1.424246
H 2.067451 -4.010463 -1.439146
H 4.072952 -5.304679 -1.710082
H 3.055323 -5.913417 -0.337725
H 4.839792 -6.192634 -0.336668


%chk=000215120-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215120

0 1
O -6.629163 -2.032517 -0.432093
O -1.802303 3.372517 0.932363
O 4.270621 -4.465629 0.088899
N -4.373726 -0.265750 0.037122
N -0.939313 1.373732 0.094474
N -0.050376 0.277455 0.122115
C -3.127119 0.261330 0.635049
C -4.194207 -1.583911 -0.621785
C -5.521443 -0.311657 0.978088
C -2.276457 0.995279 -0.429704
C -5.484617 -1.982438 -1.356993
C -6.795330 -0.721421 0.220209
C 0.501708 2.760530 1.567138
C -0.836196 2.558739 0.850828
C 1.611570 2.877284 0.544322
C 1.991479 1.716045 -0.190376
C 1.271790 0.426296 -0.001001
C 2.037838 -0.854986 -0.008499
C 2.257394 4.110484 0.290571
C 3.027349 1.818837 -1.162195
C 3.278695 4.202486 -0.678409
C 3.662476 3.051411 -1.408904
C 3.401472 -0.902182 0.404046
C 1.413798 -2.072736 -0.388580
C 4.112031 -2.113241 0.426898
C 2.114223 -3.294004 -0.376243
C 3.473323 -3.316363 0.034149
C 3.655822 -5.741843 -0.290095
H -2.507101 -0.542220 1.099991
H -3.390135 0.985410 1.427043
H -3.363161 -1.523927 -1.349268
H -3.936481 -2.377531 0.125176
H -5.346568 -1.036717 1.812707
H -5.664217 0.692512 1.419229
H -2.788035 1.920718 -0.735166
H -2.116244 0.358314 -1.314041
H -5.405781 -2.997018 -1.781980
H -5.688802 -1.250189 -2.167796
H -7.033539 0.048970 -0.544551
H -7.648853 -0.840920 0.907924
H 0.680750 1.899806 2.241809
H 0.409650 3.672499 2.175640
H 1.955224 4.998483 0.857260
H 3.313426 0.931318 -1.735904
H 3.773522 5.162150 -0.863641
H 4.448181 3.118398 -2.169069
H 3.903813 0.016110 0.724833
H 0.363212 -2.044818 -0.692437
H 5.156051 -2.155564 0.751194
H 1.603346 -4.210756 -0.685557
H 3.319083 -5.728062 -1.344754
H 2.802262 -5.988065 0.370568
H 4.451154 -6.490648 -0.164204


