%chk=000217748.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217748

0 1
F -0.166375 -2.101232 1.804601
O -2.580844 1.588166 0.191392
O 2.846113 -0.971233 1.477517
O -1.568566 1.026229 2.129777
O 4.349949 -0.397157 -0.099370
N 1.282662 2.435326 -1.393676
C 0.742714 0.258869 0.401179
C -0.234874 1.393131 0.146325
C 2.127919 0.573785 -0.127909
C 0.211850 -1.003071 -0.260631
C 0.021557 2.383266 -0.745452
C 2.345943 1.581374 -1.020351
C -1.456558 1.300299 0.958730
C -0.892579 3.503208 -1.108885
C 3.646740 1.918817 -1.661462
C 3.225295 -0.272794 0.351322
C -0.215445 -2.121370 0.472142
C 0.124739 -1.088969 -1.659151
C -0.707801 -3.286312 -0.126966
C -0.362510 -2.239918 -2.283835
C -0.777142 -3.336924 -1.520554
C -3.887697 1.430221 0.820829
C 3.841619 -1.862140 2.048831
C -4.454286 0.112063 0.393836
C -5.711484 -0.248699 0.635705
H 0.825256 0.113570 1.518113
H 1.463337 3.186694 -2.055434
H -0.581090 4.452869 -0.649791
H -1.929761 3.308010 -0.765241
H -0.970410 3.655819 -2.194545
H 4.089375 2.834593 -1.243118
H 3.574352 2.035969 -2.750587
H 4.403737 1.115770 -1.494591
H 0.443993 -0.239726 -2.263535
H -1.028386 -4.132470 0.478240
H -0.418768 -2.283290 -3.369527
H -1.154723 -4.232543 -2.011827
H -3.784845 1.505399 1.923554
H -4.449442 2.295794 0.425183
H 3.299037 -2.304631 2.891527
H 4.709243 -1.281197 2.375053
H 4.132965 -2.612656 1.307577
H -3.744833 -0.532297 -0.133566
H -6.117459 -1.203782 0.332581
H -6.430517 0.367272 1.155389


%chk=000217748-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217748

0 1
F 0.264782 -2.465792 1.761370
O -2.623198 1.878812 0.645059
O 2.904945 -1.070953 1.422944
O -1.762050 -0.013280 1.708809
O 4.514661 0.092421 0.216327
N 1.077961 2.269349 -1.420363
C 0.715331 0.074651 0.363307
C -0.375146 1.129993 0.100209
C 2.105623 0.577236 -0.067490
C 0.366499 -1.248518 -0.346925
C -0.187746 2.136334 -0.831115
C 2.234889 1.599103 -0.989556
C -1.604888 0.923961 0.879212
C -1.192058 3.169439 -1.299579
C 3.510305 2.148138 -1.589854
C 3.294558 -0.103260 0.486216
C 0.148842 -2.451777 0.358573
C 0.242356 -1.314922 -1.758596
C -0.179382 -3.668083 -0.265795
C -0.083345 -2.518241 -2.421225
C -0.296755 -3.699699 -1.672607
C -3.887458 1.661928 1.425961
C 3.998546 -1.832438 2.058609
C -4.788555 0.670512 0.735028
C -6.024357 0.974648 0.266758
H 0.731810 -0.144159 1.443054
H 1.199283 3.008612 -2.113682
H -1.438801 3.875801 -0.488844
H -2.141695 2.697559 -1.593163
H -0.793660 3.742852 -2.157512
H 3.764723 3.124908 -1.134247
H 3.387851 2.304569 -2.679447
H 4.350480 1.466116 -1.406350
H 0.406146 -0.402172 -2.342873
H -0.338670 -4.561053 0.346128
H -0.170351 -2.536390 -3.512955
H -0.551591 -4.638490 -2.175848
H -3.605689 1.302540 2.432591
H -4.342844 2.663510 1.481664
H 3.488393 -2.537501 2.729645
H 4.663440 -1.154518 2.620863
H 4.590921 -2.364228 1.294781
H -4.390870 -0.348824 0.645234
H -6.661093 0.218291 -0.205241
H -6.440143 1.987116 0.350325


