%chk=000197339.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197339

0 1
F -0.191296 3.106361 -1.166853
O 4.678505 2.312380 -0.618529
O 6.952716 1.158822 -0.486977
O 7.090083 -0.967864 0.185240
N -1.539402 0.632244 -0.670710
N 2.901064 -1.337017 0.013535
N -4.109834 -1.776993 -1.544394
C 2.304752 -2.651359 0.300368
C 2.843359 -3.481591 1.459087
C 1.480891 -2.836791 1.570553
C -3.677382 -0.526326 -0.847916
C -2.175625 -0.705413 -0.467506
C -3.654198 0.642744 -1.877046
C -2.422720 1.491121 -1.525556
C 2.072829 -0.212106 -0.298228
C -0.148525 0.744766 -0.700883
C -4.570721 -0.124750 0.327362
C 0.676403 -0.358093 -0.393478
C 4.278060 -1.209121 0.047923
C 2.696866 1.029063 -0.524787
C 0.516230 2.000520 -0.909746
C 1.885861 2.143306 -0.828854
C 4.917025 -0.016564 -0.181394
C -5.959994 -0.318067 0.241827
C -4.042883 0.486795 1.472160
C 4.168956 1.223298 -0.458816
C -4.231662 -2.960249 -0.647795
C -6.796714 0.062408 1.293378
C -4.881633 0.868820 2.524456
C -6.259244 0.653120 2.441586
C 6.378298 -0.027129 -0.128837
H 1.990506 -3.158784 -0.627104
H 3.660657 -3.109138 2.078611
H 2.931089 -4.561299 1.336450
H 0.581470 -3.449053 1.536719
H 1.342860 -1.995134 2.252028
H -2.040299 -1.016876 0.587545
H -1.714336 -1.484439 -1.118551
H -4.579730 1.241194 -1.840423
H -3.573828 0.247822 -2.908739
H -1.908561 1.837868 -2.445166
H -2.709837 2.385065 -0.927069
H -5.006534 -1.622798 -2.021518
H 0.228647 -1.334950 -0.237991
H 4.864769 -2.122674 0.263999
H 2.375644 3.114374 -0.991572
H -6.403091 -0.760518 -0.648515
H -2.972820 0.687939 1.550653
H -4.568183 -3.821155 -1.249419
H -4.927823 -2.833060 0.196740
H -3.244543 -3.221454 -0.235510
H -7.871146 -0.097728 1.216664
H -4.456061 1.341183 3.409189
H -6.911129 0.948360 3.261603
H 7.948816 1.116419 -0.432293


%chk=000197339-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197339

0 1
F -0.424690 3.075843 -1.305062
O 4.518467 2.554010 -0.414001
O 6.982313 1.324884 0.048362
O 6.958444 -0.917055 0.611501
N -1.593099 0.450287 -1.043308
N 2.871196 -1.276350 0.068385
N -4.344332 -1.878644 -1.512097
C 2.330564 -2.629771 0.192423
C 2.871827 -3.570017 1.269724
C 1.452331 -3.000562 1.396837
C -3.736794 -0.646880 -0.957826
C -2.207874 -0.864842 -0.762099
C -3.741790 0.465617 -2.056550
C -2.562971 1.386721 -1.683880
C 2.018260 -0.194295 -0.292824
C -0.237929 0.666184 -0.861080
C -4.432279 -0.109446 0.325254
C 0.633036 -0.402287 -0.493582
C 4.221807 -1.064447 0.200209
C 2.604428 1.095682 -0.459821
C 0.387183 1.953661 -0.996042
C 1.743072 2.166863 -0.813426
C 4.853201 0.169186 0.055184
C -5.842263 -0.222404 0.451929
C -3.720871 0.541909 1.366169
C 4.059430 1.373099 -0.278735
C -4.421198 -3.055707 -0.623818
C -6.519653 0.290446 1.579093
C -4.394604 1.057102 2.497228
C -5.797028 0.933112 2.610894
C 6.320249 0.120983 0.266595
H 2.063263 -3.076748 -0.772666
H 3.623742 -3.186955 1.965091
H 2.998931 -4.621379 0.999926
H 0.597962 -3.661324 1.223980
H 1.293003 -2.228330 2.154715
H -1.951642 -1.208268 0.258748
H -1.875419 -1.635531 -1.488190
H -4.697445 1.014978 -2.099350
H -3.559429 -0.023661 -3.031217
H -2.119430 1.875436 -2.566015
H -2.872764 2.176333 -0.974806
H -5.230116 -1.688472 -1.995938
H 0.221388 -1.404096 -0.374911
H 4.833032 -1.939655 0.436332
H 2.179938 3.164579 -0.923430
H -6.420250 -0.723815 -0.335034
H -2.634380 0.665343 1.295409
H -4.888184 -3.891051 -1.174466
H -4.994089 -2.889730 0.316471
H -3.401700 -3.378327 -0.343324
H -7.608181 0.186904 1.654285
H -3.822682 1.558287 3.286337
H -6.319666 1.331306 3.487518
H 7.952286 1.168792 0.220401


