%chk=000188512.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188512

0 1
F 4.839301 -0.950961 -1.096604
F 1.450062 -2.206903 1.943200
F -1.738939 -1.644335 2.745827
F -2.816267 -1.083333 -1.818175
F 0.657448 -4.158365 0.259059
F 4.053030 -2.905791 -2.785879
F 1.951203 -4.528329 -2.122843
F -3.342909 -3.720598 -2.022751
F -2.260207 -4.284795 2.547841
F -3.069151 -5.350039 0.159963
O 1.164878 2.465830 -1.170123
O 3.336700 0.901041 0.811236
O -0.527347 0.425261 0.576592
O 0.241646 4.683534 2.266614
O -4.192520 4.172259 1.169391
N -0.247599 3.770100 0.198949
N -1.994195 4.438893 1.728641
C 1.953760 1.321415 0.803875
C 1.404032 1.129914 -0.633722
C 1.993478 2.839238 1.025986
C 1.198027 3.451312 -0.128460
C 0.102971 0.326444 -0.724112
C -0.607380 4.322084 1.469600
C -1.229789 3.459137 -0.756281
C 3.601115 -0.383357 1.395808
C -2.555520 3.599222 -0.498992
C -3.039332 4.071273 0.804655
C -1.946194 0.204074 0.590862
C 3.165082 -1.498330 0.478275
C -2.375320 4.981655 3.061550
C -3.596758 3.319122 -1.528592
C -2.257860 -1.266397 0.471144
C 3.814438 -1.718477 -0.749366
C 2.096012 -2.352826 0.792655
C -2.125227 -2.129574 1.572542
C -2.673859 -1.846018 -0.738672
C 1.677014 -3.374699 -0.075569
C 3.414707 -2.733877 -1.633744
C 2.339196 -3.568131 -1.296021
C -2.950996 -3.217040 -0.857727
C -2.396377 -3.505350 1.481062
C -2.811146 -4.053909 0.259242
H 1.365699 0.778930 1.573175
H 2.181358 0.721486 -1.320532
H 3.047432 3.196053 1.003098
H 1.624943 3.128079 2.032979
H 1.650825 4.354113 -0.600767
H 0.294611 -0.744115 -0.916997
H -0.555837 0.735968 -1.510861
H -0.853746 3.098183 -1.727665
H 4.707394 -0.352407 1.510193
H 3.144959 -0.444774 2.400949
H -2.443651 0.817932 -0.183976
H -2.223917 0.613749 1.587028
H -1.712990 5.819715 3.342337
H -3.421728 5.340775 3.032912
H -2.294815 4.198700 3.833836
H -4.572485 3.098629 -1.061373
H -3.755279 4.195033 -2.176870
H -3.339780 2.469378 -2.171801


%chk=000188512-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188512

0 1
F 5.373411 -0.742323 -0.090894
F 1.066448 -2.751578 0.877621
F -2.697796 -1.936205 2.265512
F -2.200781 -2.459265 -2.522937
F 1.293632 -4.324927 -1.382321
F 5.603000 -2.336085 -2.349163
F 3.565031 -4.128029 -3.012276
F -1.646754 -5.157816 -2.169598
F -2.136151 -4.635063 2.617037
F -1.604804 -6.251064 0.402827
O 0.531252 2.270664 -0.537514
O 2.526309 0.539075 1.368705
O -1.549988 0.168798 0.036243
O 1.057108 5.643347 1.396502
O -3.480664 6.753201 0.912264
N -0.477723 3.946143 0.841434
N -1.207614 6.193265 1.144452
C 1.062958 0.575386 1.135749
C 0.763710 0.818532 -0.375488
C 0.487313 1.818640 1.832574
C 0.604057 2.946156 0.781499
C -0.435086 0.037782 -0.918830
C -0.129010 5.288516 1.139569
C -1.789400 3.562133 0.557976
C 3.081192 -0.786944 1.669206
C -2.838464 4.446880 0.566079
C -2.581543 5.859949 0.876344
C -2.726066 -0.648708 -0.314445
C 3.208847 -1.685358 0.441989
C -0.870625 7.600591 1.458091
C -4.260004 4.046589 0.255036
C -2.461255 -2.135489 -0.135669
C 4.339873 -1.620889 -0.401995
C 2.213858 -2.615930 0.078922
C -2.434364 -2.725390 1.146486
C -2.192070 -2.986453 -1.227611
C 2.311039 -3.433548 -1.062054
C 4.475026 -2.426558 -1.549807
C 3.450693 -3.335799 -1.883961
C -1.910984 -4.357160 -1.070665
C -2.153820 -4.090098 1.341735
C -1.888595 -4.908089 0.224956
H 0.595585 -0.354557 1.505797
H 1.657521 0.558586 -0.974297
H 1.041571 2.057953 2.752780
H -0.572317 1.636383 2.078258
H 1.549656 3.505921 0.863947
H -0.155553 -1.030251 -1.037455
H -0.730887 0.443872 -1.906919
H -1.914664 2.504707 0.304061
H 4.082487 -0.573501 2.074028
H 2.474414 -1.296825 2.442325
H -3.043447 -0.442968 -1.354280
H -3.508140 -0.313428 0.384315
H -0.151001 7.989869 0.719403
H -1.808015 8.174174 1.425410
H -0.409528 7.665199 2.457306
H -4.929431 4.285531 1.101168
H -4.644762 4.611556 -0.613318
H -4.332484 2.966701 0.036489


